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"id": "mp-1522577",
"created_at": "2022-09-04T14:48:06.109622Z",
"structure_string": "K1 Pr1 Dy1 Fe1 O6\n1.0\n0.000000 -4.044453 -4.044453\n4.044453 0.000000 -4.044453\n4.044453 -4.044453 0.000000\nK Pr Dy Fe O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 Pr\n0.000000 -0.000000 0.000000 Dy\n0.500000 0.500000 0.500000 Fe\n0.731011 0.268989 0.268989 O\n0.268989 0.731011 0.731011 O\n0.731011 0.268989 0.731011 O\n0.268989 0.731011 0.268989 O\n0.731011 0.731011 0.268989 O\n0.268989 0.268989 0.731011 O\n",
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"elements": [
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"Dy",
"Fe",
"O"
],
"chemical_system": "Dy-Fe-K-O-Pr",
"density": 6.204002062094108,
"density_atomic": 0.07557716999225801,
"volume": 132.3150893454251,
"volume_molar": 7.968200927101262,
"formula_full": "K1 Pr1 Dy1 Fe1 O6",
"formula_reduced": "KPrDyFeO6",
"formula_anonymous": "ABCDE6",
"energy": -73.43409734,
"energy_per_atom": -7.343409734,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -67.05609734,
"band_gap": 0.2710000000000003,
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"is_magnetic": true,
"total_magnetization": 3.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:23.546000Z",
"spacegroup": 216
},
{
"id": "mp-1519390",
"created_at": "2022-09-04T14:48:09.329529Z",
"structure_string": "Ca1 La1 Fe1 Bi1 O6\n1.0\n0.000000 5.756215 0.000000\n2.878108 -2.878108 4.283936\n5.756215 -0.000000 -0.000000\nCa La Fe Bi O\n1 1 1 1 6\ndirect\n0.250000 0.500000 0.250000 Ca\n0.500000 -0.000000 0.500000 La\n0.000000 -0.000000 0.000000 Fe\n0.750000 0.500000 0.750000 Bi\n0.765502 0.531005 0.234498 O\n0.234498 0.468995 0.765502 O\n0.864117 0.991388 0.691838 O\n0.127272 0.991388 0.316774 O\n0.316774 0.008612 0.864117 O\n0.691838 0.008612 0.127272 O\n",
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"nelements": 5,
"elements": [
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"Fe",
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"O"
],
"chemical_system": "Bi-Ca-Fe-La-O",
"density": 6.314940018525619,
"density_atomic": 0.07045032682926651,
"volume": 141.9439830880358,
"volume_molar": 8.54806646191211,
"formula_full": "Ca1 La1 Fe1 Bi1 O6",
"formula_reduced": "CaLaFeBiO6",
"formula_anonymous": "ABCDE6",
"energy": -71.4332375,
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"updated_at": "2021-11-28T01:38:22.911000Z",
"spacegroup": 82
}
]
}