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{
"id": "mp-1180046",
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"structure_string": "Ni2 S4\n1.0\n5.250117 0.000000 0.000000\n0.000000 4.190608 0.000000\n0.000000 2.228376 4.856146\nNi S\n2 4\ndirect\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.116718 0.649771 0.827678 S\n0.383282 0.649771 0.327678 S\n0.883282 0.350229 0.172322 S\n0.616718 0.350229 0.672322 S\n",
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{
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"spacegroup": 186
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{
"id": "mp-1022621",
"created_at": "2022-09-04T14:45:28.454796Z",
"structure_string": "Mg12 Zn2 Cu2\n1.0\n4.944464 0.000000 0.000000\n0.000000 5.998818 0.000000\n0.000000 0.000000 10.550665\nMg Zn Cu\n12 2 2\ndirect\n0.000000 0.259017 0.088708 Mg\n0.000000 0.740983 0.088708 Mg\n0.000000 0.000000 0.332147 Mg\n0.500000 0.744806 0.412960 Mg\n0.500000 0.255194 0.412960 Mg\n0.500000 0.000000 0.167270 Mg\n0.000000 0.759017 0.588708 Mg\n0.000000 0.240983 0.588708 Mg\n0.000000 0.500000 0.832147 Mg\n0.500000 0.244806 0.912960 Mg\n0.500000 0.755194 0.912960 Mg\n0.500000 0.500000 0.667270 Mg\n0.000000 0.500000 0.331685 Zn\n0.000000 0.000000 0.831685 Zn\n0.500000 0.500000 0.165560 Cu\n0.500000 0.000000 0.665560 Cu\n",
"nsites": 16,
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],
"chemical_system": "Cu-Mg-Zn",
"density": 2.916133325106654,
"density_atomic": 0.05112758080619523,
"volume": 312.94263776433655,
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"formula_full": "Mg12 Zn2 Cu2",
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"spacegroup": 38
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{
"id": "mp-4233",
"created_at": "2022-09-04T14:42:03.413829Z",
"structure_string": "K2 Mn2 Sb2\n1.0\n4.669289 0.000000 0.000000\n0.000000 4.669289 0.000000\n0.000000 0.000000 8.298060\nK Mn Sb\n2 2 2\ndirect\n0.500000 0.000000 0.654365 K\n0.000000 0.500000 0.345635 K\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 0.186310 Sb\n0.000000 0.500000 0.813690 Sb\n",
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"density": 3.9613671631188945,
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{
"id": "mp-2550",
"created_at": "2022-09-04T14:40:08.769289Z",
"structure_string": "Nd2 Te4\n1.0\n4.508331 0.000000 0.000000\n0.000000 4.508331 0.000000\n0.000000 0.000000 9.189379\nNd Te\n2 4\ndirect\n0.000000 0.500000 0.727377 Nd\n0.500000 0.000000 0.272623 Nd\n0.000000 0.500000 0.369803 Te\n0.500000 0.000000 0.630197 Te\n0.500000 0.500000 0.000000 Te\n0.000000 0.000000 0.000000 Te\n",
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"density_atomic": 0.032124287069072964,
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"formula_full": "Nd2 Te4",
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{
"id": "mp-1227955",
"created_at": "2022-09-04T14:42:28.769827Z",
"structure_string": "Ba1 Bi1 O3\n1.0\n3.135045 -3.139076 0.000000\n3.135045 3.139076 0.000000\n-0.008066 0.000000 4.436467\nBa Bi O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Bi\n0.010859 0.500000 0.989141 O\n0.500000 0.989141 0.010859 O\n0.989141 0.010859 0.500000 O\n",
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"volume": 87.31982579640245,
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"formula_full": "Ba1 Bi1 O3",
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"updated_at": "2021-11-28T01:35:50.911000Z",
"spacegroup": 155
},
{
"id": "mp-1214412",
"created_at": "2022-09-04T14:40:57.977331Z",
"structure_string": "Ba8 Rh2\n1.0\n-6.584167 -6.584167 0.000000\n-6.584167 0.000000 -6.584167\n0.000000 -6.584167 -6.584167\nBa Rh\n8 2\ndirect\n0.623874 0.623874 0.623874 Ba\n0.128377 0.623874 0.623874 Ba\n0.623874 0.128377 0.623874 Ba\n0.621623 0.126126 0.126126 Ba\n0.126126 0.126126 0.126126 Ba\n0.623874 0.623874 0.128377 Ba\n0.126126 0.621623 0.126126 Ba\n0.126126 0.126126 0.621623 Ba\n0.000000 0.000000 0.000000 Rh\n0.750000 0.750000 0.750000 Rh\n",
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"volume": 570.8638062638483,
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"formula_full": "Ba8 Rh2",
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{
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"created_at": "2022-09-04T14:43:52.485549Z",
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"volume": 224.5875878511777,
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{
"id": "mp-4990",
"created_at": "2022-09-04T14:45:18.092143Z",
"structure_string": "Mn1 Sn1 Rh2\n1.0\n0.000000 3.153447 3.153447\n3.153447 0.000000 3.153447\n3.153447 3.153447 0.000000\nMn Sn Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Sn\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n",
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"formula_full": "Mn1 Sn1 Rh2",
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{
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{
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{
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]
}