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{
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{
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{
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{
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"id": "mp-22165",
"created_at": "2022-09-04T14:42:51.218789Z",
"structure_string": "Ce2 Co8 B8\n1.0\n5.043719 0.000000 0.000000\n0.000000 5.043719 0.000000\n0.000000 0.000000 7.033290\nCe Co B\n2 8 8\ndirect\n0.500000 0.500000 0.000000 Ce\n0.000000 0.000000 0.500000 Ce\n0.747862 0.500000 0.637518 Co\n0.252138 0.500000 0.637518 Co\n0.500000 0.747862 0.362482 Co\n0.752138 0.000000 0.862482 Co\n0.247862 0.000000 0.862482 Co\n0.000000 0.752138 0.137518 Co\n0.000000 0.247862 0.137518 Co\n0.500000 0.252138 0.362482 Co\n0.500000 0.826783 0.658235 B\n0.673217 0.000000 0.158235 B\n0.326783 0.000000 0.158235 B\n0.000000 0.673217 0.841765 B\n0.000000 0.326783 0.841765 B\n0.500000 0.173217 0.658235 B\n0.826783 0.500000 0.341765 B\n0.173217 0.500000 0.341765 B\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ce",
"Co",
"B"
],
"chemical_system": "B-Ce-Co",
"density": 7.779093325556825,
"density_atomic": 0.10060329721519434,
"volume": 178.92057714070052,
"volume_molar": 5.9860272244540935,
"formula_full": "Ce2 Co8 B8",
"formula_reduced": "Ce(CoB)4",
"formula_anonymous": "AB4C4",
"energy": -130.63327355,
"energy_per_atom": -7.257404086111112,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -130.63327355,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.001249,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:56.822000Z",
"spacegroup": 137
}
]
}