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"structure_string": "Sr1 La1 Eu1 Sb1 O6\n1.0\n-0.000000 -4.311002 -4.311002\n4.311002 0.000000 -4.311002\n4.311002 -4.311002 -0.000000\nSr La Eu Sb O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n-0.000000 -0.000000 -0.000000 La\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 Sb\n0.731342 0.268658 0.268658 O\n0.268658 0.731342 0.731342 O\n0.731342 0.268658 0.731342 O\n0.268658 0.731342 0.268658 O\n0.731342 0.731342 0.268658 O\n0.268658 0.268658 0.731342 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
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"La",
"Eu",
"Sb",
"O"
],
"chemical_system": "Eu-La-O-Sb-Sr",
"density": 6.178880736563127,
"density_atomic": 0.06240729105208669,
"volume": 160.23768747875548,
"volume_molar": 9.64973909053955,
"formula_full": "Sr1 La1 Eu1 Sb1 O6",
"formula_reduced": "SrLaEuSbO6",
"formula_anonymous": "ABCDE6",
"energy": -79.88199128,
"energy_per_atom": -7.988199128,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -75.75999128,
"band_gap": 0.5564,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.9999998,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:36.558000Z",
"spacegroup": 216
},
{
"id": "mp-1517490",
"created_at": "2022-09-04T14:44:25.351829Z",
"structure_string": "Sr1 Ca1 Eu1 Se1 O6\n1.0\n0.000000 -4.041662 -4.041662\n4.041662 0.000000 -4.041662\n4.041662 -4.041662 -0.000000\nSr Ca Eu Se O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n-0.000000 0.000000 0.000000 Ca\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 Se\n0.725530 0.274470 0.274470 O\n0.274470 0.725530 0.725530 O\n0.725530 0.274470 0.725530 O\n0.274470 0.725530 0.274470 O\n0.725530 0.725530 0.274470 O\n0.274470 0.274470 0.725530 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
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"Ca",
"Eu",
"Se",
"O"
],
"chemical_system": "Ca-Eu-O-Se-Sr",
"density": 5.717236236589563,
"density_atomic": 0.0757338492828563,
"volume": 132.0413539611762,
"volume_molar": 7.9517161969518675,
"formula_full": "Sr1 Ca1 Eu1 Se1 O6",
"formula_reduced": "SrCaEuSeO6",
"formula_anonymous": "ABCDE6",
"energy": -72.47836772,
"energy_per_atom": -7.247836771999999,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
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"energy_uncorrected": -68.35636772,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.9892148,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:23.553000Z",
"spacegroup": 216
}
]
}