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{
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"nelements": 3,
"elements": [
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],
"chemical_system": "Ag-Sb-Te",
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"density_atomic": 0.0350896500103814,
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"volume_molar": 17.162156813243588,
"formula_full": "Ag4 Sb4 Te8",
"formula_reduced": "AgSbTe2",
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"formation_energy": null,
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"energy_uncorrected": -52.21935853,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:34:43.441000Z",
"spacegroup": 131
},
{
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"created_at": "2022-09-04T14:42:11.232568Z",
"structure_string": "Ag4 Se12 I4\n1.0\n5.101597 0.000000 0.000000\n0.000000 8.251258 0.000000\n0.000000 0.000000 15.050090\nAg Se I\n4 12 4\ndirect\n0.697708 0.250000 0.750000 Ag\n0.302292 0.750000 0.250000 Ag\n0.302292 0.750000 0.750000 Ag\n0.697708 0.250000 0.250000 Ag\n0.385662 0.369795 0.621132 Se\n0.614338 0.869795 0.878868 Se\n0.600801 0.261043 0.000000 Se\n0.614338 0.869795 0.121132 Se\n0.399199 0.738957 0.000000 Se\n0.614338 0.630205 0.621132 Se\n0.385662 0.369795 0.378868 Se\n0.600801 0.238957 0.500000 Se\n0.399199 0.761043 0.500000 Se\n0.614338 0.630205 0.378868 Se\n0.385662 0.130205 0.121132 Se\n0.385662 0.130205 0.878868 Se\n0.000000 0.500000 0.165775 I\n0.000000 0.000000 0.334225 I\n0.000000 0.000000 0.665775 I\n0.000000 0.500000 0.834225 I\n",
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"elements": [
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"chemical_system": "Ag-I-Se",
"density": 4.944996330259913,
"density_atomic": 0.03156927317807804,
"volume": 633.5274140517166,
"volume_molar": 19.075956313691197,
"formula_full": "Ag4 Se12 I4",
"formula_reduced": "AgSe3I",
"formula_anonymous": "ABC3",
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"total_magnetization": 1.2e-06,
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"updated_at": "2021-11-28T01:35:37.896000Z",
"spacegroup": 53
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{
"id": "mp-32758",
"created_at": "2022-09-04T14:41:02.923147Z",
"structure_string": "Ag4 Se2\n1.0\n2.479695 -3.636743 0.000000\n2.479695 3.636743 0.000000\n0.000000 0.000000 7.220818\nAg Se\n4 2\ndirect\n0.850619 0.149381 0.359787 Ag\n0.649381 0.350619 0.859787 Ag\n0.350619 0.649381 0.140213 Ag\n0.149381 0.850619 0.640213 Ag\n0.500000 0.500000 0.500000 Se\n0.000000 0.000000 0.000000 Se\n",
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"elements": [
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],
"chemical_system": "Ag-Se",
"density": 7.514959619881475,
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"volume": 130.23486744805643,
"volume_molar": 13.07154506053563,
"formula_full": "Ag4 Se2",
"formula_reduced": "Ag2Se",
"formula_anonymous": "AB2",
"energy": -19.45732027,
"energy_per_atom": -3.242886711666667,
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"total_magnetization": 0.0003605,
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"updated_at": "2021-11-28T01:35:09.215000Z",
"spacegroup": 64
}
]
}