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"created_at": "2022-09-04T14:39:20.825877Z",
"structure_string": "Tb1 Eu2 Ta1 O6\n1.0\n0.000000 4.213847 4.213847\n4.213847 0.000000 4.213847\n4.213847 4.213847 0.000000\nTb Eu Ta O\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 Tb\n0.250000 0.250000 0.250000 Eu\n0.750000 0.750000 0.750000 Eu\n0.000000 0.000000 0.000000 Ta\n0.763559 0.236441 0.236441 O\n0.236441 0.763559 0.763559 O\n0.236441 0.763559 0.236441 O\n0.763559 0.236441 0.763559 O\n0.236441 0.236441 0.763559 O\n0.763559 0.763559 0.236441 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Tb",
"Eu",
"Ta",
"O"
],
"chemical_system": "Eu-O-Ta-Tb",
"density": 8.209103835778047,
"density_atomic": 0.06682419194772964,
"volume": 149.64640362313804,
"volume_molar": 9.011917068463113,
"formula_full": "Tb1 Eu2 Ta1 O6",
"formula_reduced": "TbEu2TaO6",
"formula_anonymous": "ABC2D6",
"energy": -101.3405037,
"energy_per_atom": -10.13405037,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -97.2185037,
"band_gap": 0.7809999999999997,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 14.0206698,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:41.177000Z",
"spacegroup": 225
},
{
"id": "mp-1184582",
"created_at": "2022-09-04T14:46:07.629385Z",
"structure_string": "Hf1 Nb1 Ru2\n1.0\n0.000000 3.215070 3.215070\n3.215070 0.000000 3.215070\n3.215070 3.215070 0.000000\nHf Nb Ru\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Nb\n0.250000 0.250000 0.250000 Ru\n0.750000 0.750000 0.750000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Nb",
"Ru"
],
"chemical_system": "Hf-Nb-Ru",
"density": 11.83044695315359,
"density_atomic": 0.06018090253612587,
"volume": 66.46626805902169,
"volume_molar": 10.006730551083017,
"formula_full": "Hf1 Nb1 Ru2",
"formula_reduced": "HfNbRu2",
"formula_anonymous": "ABC2",
"energy": -40.53401118,
"energy_per_atom": -10.133502795,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -40.53401118,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0013497,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:24.743000Z",
"spacegroup": 225
}
]
}