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"id": "mp-558154",
"created_at": "2022-09-04T14:39:07.699099Z",
"structure_string": "Ag6 P2 O8\n1.0\n6.032654 0.000000 0.000000\n0.000000 6.032654 0.000000\n0.000000 0.000000 6.032654\nAg P O\n6 2 8\ndirect\n0.000000 0.500000 0.750000 Ag\n0.750000 0.000000 0.500000 Ag\n0.250000 0.000000 0.500000 Ag\n0.500000 0.250000 0.000000 Ag\n0.000000 0.500000 0.250000 Ag\n0.500000 0.750000 0.000000 Ag\n0.500000 0.500000 0.500000 P\n0.000000 0.000000 0.000000 P\n0.750000 0.250000 0.750000 O\n0.250000 0.250000 0.250000 O\n0.250000 0.750000 0.750000 O\n0.750000 0.750000 0.250000 O\n0.750000 0.250000 0.250000 O\n0.250000 0.750000 0.250000 O\n0.250000 0.250000 0.750000 O\n0.750000 0.750000 0.750000 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ag",
"P",
"O"
],
"chemical_system": "Ag-O-P",
"density": 6.331813658222643,
"density_atomic": 0.07287771222578629,
"volume": 219.54585992531648,
"volume_molar": 8.26335044840937,
"formula_full": "Ag6 P2 O8",
"formula_reduced": "Ag3PO4",
"formula_anonymous": "AB3C4",
"energy": -70.44986028,
"energy_per_atom": -4.4031162675,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -64.95386028,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0042089,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:30.767000Z",
"spacegroup": 223
}
]
}