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            "created_at": "2022-09-04T14:44:24.794862Z",
            "structure_string": "Nd4 Mg2 Se8\n1.0\n0.000000 6.003146 6.003146\n6.003146 0.000000 6.003146\n6.003146 6.003146 0.000000\nNd Mg Se\n4 2 8\ndirect\n0.125000 0.625000 0.125000 Nd\n0.125000 0.125000 0.625000 Nd\n0.625000 0.125000 0.125000 Nd\n0.125000 0.125000 0.125000 Nd\n0.500000 0.500000 0.500000 Mg\n0.750000 0.750000 0.750000 Mg\n0.877745 0.877745 0.877745 Se\n0.366765 0.877745 0.877745 Se\n0.877745 0.366765 0.877745 Se\n0.877745 0.877745 0.366765 Se\n0.372255 0.372255 0.883235 Se\n0.372255 0.883235 0.372255 Se\n0.883235 0.372255 0.372255 Se\n0.372255 0.372255 0.372255 Se\n",
            "nsites": 14,
            "nelements": 3,
            "elements": [
                "Nd",
                "Mg",
                "Se"
            ],
            "chemical_system": "Mg-Nd-Se",
            "density": 4.82510526287892,
            "density_atomic": 0.032356483966601464,
            "volume": 432.67989236564995,
            "volume_molar": 18.611851541768523,
            "formula_full": "Nd4 Mg2 Se8",
            "formula_reduced": "Nd2MgSe4",
            "formula_anonymous": "AB2C4",
            "energy": -77.12644637,
            "energy_per_atom": -5.509031883571429,
            "energy_above_hull": null,
            "is_stable": null,
            "decomposes_to": null,
            "formation_energy": null,
            "formation_energy_per_atom": null,
            "energy_uncorrected": -73.35044637,
            "band_gap": 1.0688999999999995,
            "is_gap_direct": true,
            "is_magnetic": false,
            "total_magnetization": 8.91e-05,
            "is_theoretical": true,
            "updated_at": "2021-11-28T01:36:44.172000Z",
            "spacegroup": 227
        }
    ]
}