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{
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{
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{
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{
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{
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"formula_reduced": "YNiAs",
"formula_anonymous": "ABC",
"energy": -20.07792765,
"energy_per_atom": -6.6926425499999995,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.07792765,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002192,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:08.238000Z",
"spacegroup": 187
},
{
"id": "mp-1217701",
"created_at": "2022-09-04T14:45:35.756326Z",
"structure_string": "Tb4 Cu2 Pt2\n1.0\n4.461766 0.000000 0.000000\n0.000000 5.533304 0.000000\n0.000000 0.000000 7.176419\nTb Cu Pt\n4 2 2\ndirect\n0.000000 0.113500 0.684835 Tb\n0.000000 0.886500 0.184835 Tb\n0.500000 0.395337 0.314938 Tb\n0.500000 0.604663 0.814938 Tb\n0.500000 0.892932 0.464378 Cu\n0.500000 0.107068 0.964378 Cu\n0.000000 0.613619 0.535850 Pt\n0.000000 0.386381 0.035850 Pt\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tb",
"Cu",
"Pt"
],
"chemical_system": "Cu-Pt-Tb",
"density": 10.80599487346511,
"density_atomic": 0.04515344378560037,
"volume": 177.17364013221146,
"volume_molar": 13.337057497972031,
"formula_full": "Tb4 Cu2 Pt2",
"formula_reduced": "Tb2CuPt",
"formula_anonymous": "ABC2",
"energy": -45.19928285,
"energy_per_atom": -5.64991035625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -45.19928285,
"band_gap": 0.0,
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"total_magnetization": 0.0001212,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:07.415000Z",
"spacegroup": 26
}
]
}