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"chemical_system": "Fe-H-Li-O-P",
"density": 2.7932531147301414,
"density_atomic": 0.08386089722055537,
"volume": 286.188209230336,
"volume_molar": 7.1811069993225605,
"formula_full": "Li3 Fe2 P4 H1 O14",
"formula_reduced": "Li3Fe2P4HO14",
"formula_anonymous": "AB2C3D4E14",
"energy": -162.44022014,
"energy_per_atom": -6.768342505833334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -148.31022014,
"band_gap": 2.4461,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.4e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:01.762000Z",
"spacegroup": 2
},
{
"id": "mp-769253",
"created_at": "2022-09-04T14:47:23.815487Z",
"structure_string": "Dy2 Se1 O2\n1.0\n-1.918820 1.918820 6.081080\n1.918820 -1.918820 6.081080\n1.918820 1.918820 -6.081080\nDy Se O\n2 1 2\ndirect\n0.343388 0.343388 0.000000 Dy\n0.656612 0.656612 0.000000 Dy\n0.000000 0.000000 0.000000 Se\n0.750000 0.250000 0.500000 O\n0.250000 0.750000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Dy",
"Se",
"O"
],
"chemical_system": "Dy-O-Se",
"density": 8.083237973811574,
"density_atomic": 0.055829125242675116,
"volume": 89.55898875839917,
"volume_molar": 10.78673673252675,
"formula_full": "Dy2 Se1 O2",
"formula_reduced": "Dy2SeO2",
"formula_anonymous": "AB2C2",
"energy": -39.86322806,
"energy_per_atom": -7.972645611999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.01722806,
"band_gap": 2.0807999999999995,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001991,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:08.166000Z",
"spacegroup": 139
}
]
}