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"spacegroup": 62
},
{
"id": "mp-961681",
"created_at": "2022-09-04T14:44:22.538029Z",
"structure_string": "Zr1 Ge1 Pt1\n1.0\n0.000000 3.171343 3.171343\n3.171343 0.000000 3.171343\n3.171343 3.171343 0.000000\nZr Ge Pt\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Zr\n0.000000 0.000000 0.000000 Ge\n0.500000 0.500000 0.500000 Pt\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Zr",
"Ge",
"Pt"
],
"chemical_system": "Ge-Pt-Zr",
"density": 9.343745292493761,
"density_atomic": 0.04702855237786278,
"volume": 63.79103434644857,
"volume_molar": 12.80528626867693,
"formula_full": "Zr1 Ge1 Pt1",
"formula_reduced": "ZrGePt",
"formula_anonymous": "ABC",
"energy": -20.37202562,
"energy_per_atom": -6.790675206666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.37202562,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 7.87e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:20.498000Z",
"spacegroup": 216
}
]
}