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{
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"volume_molar": 8.248858513343377,
"formula_full": "Ca1 Eu1 Hf1 Nb1 O6",
"formula_reduced": "CaEuHfNbO6",
"formula_anonymous": "ABCDE6",
"energy": -95.63237337,
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"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -91.51037337,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:37:36.657000Z",
"spacegroup": 216
},
{
"id": "mp-1518683",
"created_at": "2022-09-04T14:39:49.940753Z",
"structure_string": "Sr1 Nd1 Zr1 Ti1 O6\n1.0\n0.000000 -4.059357 -4.059357\n4.059357 0.000000 -4.059357\n4.059357 -4.059357 0.000000\nSr Nd Zr Ti O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Nd\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Ti\n0.756833 0.243167 0.243167 O\n0.243167 0.756833 0.756833 O\n0.756833 0.243167 0.756833 O\n0.243167 0.756833 0.243167 O\n0.756833 0.756833 0.243167 O\n0.243167 0.243167 0.756833 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Nd",
"Zr",
"Ti",
"O"
],
"chemical_system": "Nd-O-Sr-Ti-Zr",
"density": 5.795850604864904,
"density_atomic": 0.07474777390974156,
"volume": 133.783248342286,
"volume_molar": 8.056615528472829,
"formula_full": "Sr1 Nd1 Zr1 Ti1 O6",
"formula_reduced": "SrNdZrTiO6",
"formula_anonymous": "ABCDE6",
"energy": -87.43624166000001,
"energy_per_atom": -8.743624166,
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"is_stable": null,
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"energy_uncorrected": -83.31424166,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0019993,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:31.647000Z",
"spacegroup": 216
}
]
}