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{
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],
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"density_atomic": 0.07826473670587121,
"volume": 127.77146414714544,
"volume_molar": 7.6945774220540315,
"formula_full": "Ca1 Eu1 Ti1 Nb1 O6",
"formula_reduced": "CaEuTiNbO6",
"formula_anonymous": "ABCDE6",
"energy": -93.14708989,
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"is_stable": null,
"decomposes_to": null,
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"energy_uncorrected": -89.02508989,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:32.964000Z",
"spacegroup": 216
},
{
"id": "mp-1520837",
"created_at": "2022-09-04T14:40:54.326290Z",
"structure_string": "Ba1 Y1 Nb1 Sn1 O6\n1.0\n-0.000000 -4.249123 -4.249123\n4.249123 0.000000 -4.249123\n4.249123 -4.249123 -0.000000\nBa Y Nb Sn O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Nb\n0.250000 0.250000 0.250000 Sn\n0.763189 0.236811 0.236811 O\n0.236811 0.763189 0.763189 O\n0.763189 0.236811 0.763189 O\n0.236811 0.763189 0.236811 O\n0.763189 0.763189 0.236811 O\n0.236811 0.236811 0.763189 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Y",
"Nb",
"Sn",
"O"
],
"chemical_system": "Ba-Nb-O-Sn-Y",
"density": 5.77745917348653,
"density_atomic": 0.06517365776678316,
"volume": 153.43622473644047,
"volume_molar": 9.240145430458384,
"formula_full": "Ba1 Y1 Nb1 Sn1 O6",
"formula_reduced": "BaYNbSnO6",
"formula_anonymous": "ABCDE6",
"energy": -81.79635385,
"energy_per_atom": -8.179635385000001,
"energy_above_hull": null,
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"energy_uncorrected": -77.67435385,
"band_gap": 2.4439,
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"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:56.820000Z",
"spacegroup": 216
}
]
}