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{
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{
"id": "mp-1184635",
"created_at": "2022-09-04T14:48:04.137951Z",
"structure_string": "Ho2 Zn1 Ga1\n1.0\n0.000000 3.546567 3.546567\n3.546567 0.000000 3.546567\n3.546567 3.546567 0.000000\nHo Zn Ga\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ho\n0.750000 0.750000 0.750000 Ho\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Ga\n",
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{
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"updated_at": "2021-11-28T01:35:48.524000Z",
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{
"id": "mp-7438",
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"structure_string": "K2 Zn2 Sb2\n1.0\n2.289960 -3.966327 0.000000\n2.289960 3.966327 0.000000\n0.000000 0.000000 10.729536\nK Zn Sb\n2 2 2\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.000000 0.500000 K\n0.333333 0.666667 0.750000 Zn\n0.666667 0.333333 0.250000 Zn\n0.333333 0.666667 0.250000 Sb\n0.666667 0.333333 0.750000 Sb\n",
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"density": 3.855436353400609,
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"volume": 194.90696082309904,
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"formula_full": "K2 Zn2 Sb2",
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"updated_at": "2021-11-28T01:36:26.261000Z",
"spacegroup": 194
},
{
"id": "mp-1223433",
"created_at": "2022-09-04T14:41:47.416382Z",
"structure_string": "K1 Bi1 S2\n1.0\n4.261900 0.000000 0.000000\n0.000000 4.261900 0.000000\n0.000000 0.000000 5.790006\nK Bi S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.500000 S\n0.500000 0.500000 0.000000 S\n",
"nsites": 4,
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"elements": [
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"density": 4.929564732891623,
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"volume": 105.16846240464965,
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"formula_full": "K1 Bi1 S2",
"formula_reduced": "KBiS2",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:35:28.869000Z",
"spacegroup": 123
},
{
"id": "mp-1186421",
"created_at": "2022-09-04T14:48:18.699638Z",
"structure_string": "Pb3 O1\n1.0\n4.671716 0.000000 0.000000\n0.000000 4.671716 0.000000\n0.000000 0.000000 4.671716\nPb O\n3 1\ndirect\n0.500000 0.000000 0.500000 Pb\n0.000000 0.500000 0.500000 Pb\n0.500000 0.500000 0.000000 Pb\n0.000000 0.000000 0.000000 O\n",
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"elements": [
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"density": 10.384072138227456,
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"volume": 101.9598764768836,
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"formula_full": "Pb3 O1",
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"updated_at": "2021-11-28T01:39:00.800000Z",
"spacegroup": 221
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{
"id": "mp-1188060",
"created_at": "2022-09-04T14:41:08.688186Z",
"structure_string": "Yb3 Np1\n1.0\n5.159125 0.000000 0.000000\n0.000000 5.159125 0.000000\n0.000000 0.000000 5.159125\nYb Np\n3 1\ndirect\n0.000000 0.500000 0.500000 Yb\n0.500000 0.000000 0.500000 Yb\n0.500000 0.500000 0.000000 Yb\n0.000000 0.000000 0.000000 Np\n",
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"density": 9.14348320857003,
"density_atomic": 0.02912942016491238,
"volume": 137.3182156512051,
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"formula_full": "Yb3 Np1",
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:08.816000Z",
"spacegroup": 221
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{
"id": "mp-1215413",
"created_at": "2022-09-04T14:44:17.380714Z",
"structure_string": "Zn1 Cu2 Ni1\n1.0\n8.273982 -1.297209 0.000000\n8.273982 1.297209 0.000000\n8.070603 0.000000 2.237608\nZn Cu Ni\n1 2 1\ndirect\n0.748081 0.748081 0.748081 Zn\n0.501119 0.501119 0.501119 Cu\n0.251229 0.251229 0.251229 Cu\n0.999571 0.999571 0.999571 Ni\n",
"nsites": 4,
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"Cu",
"Ni"
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"density": 8.684014182639356,
"density_atomic": 0.08327630836955449,
"volume": 48.03286887129095,
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"formula_full": "Zn1 Cu2 Ni1",
"formula_reduced": "ZnCu2Ni",
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"updated_at": "2021-11-28T01:36:29.783000Z",
"spacegroup": 160
},
{
"id": "mp-1094584",
"created_at": "2022-09-04T14:42:54.077282Z",
"structure_string": "Mg4 Sb2\n1.0\n1.776482 5.657398 0.000000\n-1.776482 5.657398 0.000000\n0.000000 2.903051 7.248044\nMg Sb\n4 2\ndirect\n0.839953 0.839953 0.124944 Mg\n0.145897 0.145897 0.469609 Mg\n0.854103 0.854103 0.530391 Mg\n0.160047 0.160047 0.875056 Mg\n0.553271 0.553271 0.215513 Sb\n0.446729 0.446729 0.784487 Sb\n",
"nsites": 6,
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"elements": [
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"density": 3.88368373095269,
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"volume": 145.68953621114946,
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"formula_full": "Mg4 Sb2",
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"updated_at": "2021-11-28T01:35:59.476000Z",
"spacegroup": 12
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{
"id": "mp-13911",
"created_at": "2022-09-04T14:41:07.626162Z",
"structure_string": "Ca1 Zn2 Ge2\n1.0\n-2.162141 2.162141 5.342483\n2.162141 -2.162141 5.342483\n2.162141 2.162141 -5.342483\nCa Zn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.250000 0.750000 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n0.382406 0.382406 0.000000 Ge\n0.617594 0.617594 0.000000 Ge\n",
"nsites": 5,
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"elements": [
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"Zn",
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"density": 5.25541278882494,
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"volume": 99.9013057618851,
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"updated_at": "2021-11-28T01:35:16.051000Z",
"spacegroup": 139
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{
"id": "mp-1183549",
"created_at": "2022-09-04T14:45:28.277639Z",
"structure_string": "Ca1 Tb3\n1.0\n5.109847 0.000000 0.000000\n0.000000 5.109847 0.000000\n0.000000 0.000000 5.109847\nCa Tb\n1 3\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.500000 0.500000 Tb\n0.500000 0.000000 0.500000 Tb\n0.500000 0.500000 0.000000 Tb\n",
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{
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"structure_string": "Pm1 Al1 Ag2\n1.0\n0.000000 3.485201 3.485201\n3.485201 0.000000 3.485201\n3.485201 3.485201 0.000000\nPm Al Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500000 0.500000 0.500000 Al\n0.250000 0.250000 0.250000 Ag\n0.750000 0.750000 0.750000 Ag\n",
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{
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"created_at": "2022-09-04T14:45:21.000965Z",
"structure_string": "Pt1 S2\n1.0\n1.790037 -3.100435 0.000000\n1.790037 3.100435 0.000000\n0.000000 0.000000 6.250867\nPt S\n1 2\ndirect\n0.000000 0.000000 0.000000 Pt\n0.666667 0.333333 0.803480 S\n0.333333 0.666667 0.196520 S\n",
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"updated_at": "2021-11-28T01:37:00.254000Z",
"spacegroup": 164
}
]
}