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{
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{
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"structure_string": "Ce1 Mg12\n1.0\n-5.195062 5.195062 2.912782\n5.195062 -5.195062 2.912782\n5.195062 5.195062 -2.912782\nCe Mg\n1 12\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.284452 0.784452 Mg\n0.500000 0.715548 0.215548 Mg\n0.715548 0.500000 0.215548 Mg\n0.284452 0.500000 0.784452 Mg\n0.000000 0.349263 0.349263 Mg\n0.000000 0.650737 0.650737 Mg\n0.650737 0.000000 0.650737 Mg\n0.349263 0.000000 0.349263 Mg\n0.000000 0.000000 0.500000 Mg\n0.500000 0.500000 0.500000 Mg\n0.500000 0.000000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Ce",
"Mg"
],
"chemical_system": "Ce-Mg",
"density": 2.2801223558945303,
"density_atomic": 0.04134223096363476,
"volume": 314.448439210622,
"volume_molar": 14.566559712989761,
"formula_full": "Ce1 Mg12",
"formula_reduced": "CeMg12",
"formula_anonymous": "AB12",
"energy": -25.14685958,
"energy_per_atom": -1.934373813846154,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.14685958,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.1931857,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:26.063000Z",
"spacegroup": 139
},
{
"id": "mp-1039594",
"created_at": "2022-09-04T14:41:00.059097Z",
"structure_string": "Ce3 Mg3\n1.0\n1.584882 6.524270 0.000000\n-1.584882 6.524270 0.000000\n0.000000 1.883330 7.417538\nCe Mg\n3 3\ndirect\n0.666126 0.666126 0.655176 Ce\n0.078813 0.078813 0.392057 Ce\n0.699350 0.699350 0.070385 Ce\n0.984254 0.984254 0.001052 Mg\n0.390052 0.390052 0.721212 Mg\n0.348073 0.348073 0.326786 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Mg"
],
"chemical_system": "Ce-Mg",
"density": 5.33960342916649,
"density_atomic": 0.039114034659966386,
"volume": 153.39762446294145,
"volume_molar": 15.396368112757548,
"formula_full": "Ce3 Mg3",
"formula_reduced": "CeMg",
"formula_anonymous": "AB",
"energy": -22.40866257,
"energy_per_atom": -3.734777095,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.40866257,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.5936747,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:11.210000Z",
"spacegroup": 8
}
]
}