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{
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"id": "mp-1067210",
"created_at": "2022-09-04T14:44:49.395868Z",
"structure_string": "Zr2 Cu2\n1.0\n4.138216 0.000000 0.000000\n0.000000 3.242189 0.000000\n0.000000 1.510362 5.298499\nZr Cu\n2 2\ndirect\n0.750000 0.647402 0.193675 Zr\n0.250000 0.352598 0.806325 Zr\n0.750000 0.940783 0.637697 Cu\n0.250000 0.059217 0.362303 Cu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Cu"
],
"chemical_system": "Cu-Zr",
"density": 7.230386872677641,
"density_atomic": 0.056267244959059604,
"volume": 71.08931675809656,
"volume_molar": 10.702746801237106,
"formula_full": "Zr2 Cu2",
"formula_reduced": "ZrCu",
"formula_anonymous": "AB",
"energy": -25.79400955,
"energy_per_atom": -6.4485023875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.79400955,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9.3e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:41.187000Z",
"spacegroup": 11
}
]
}