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"id": "mp-1192149",
"created_at": "2022-09-04T14:43:04.055424Z",
"structure_string": "Ho4 Ni4 B16\n1.0\n-3.756036 3.756036 4.248434\n3.756036 -3.756036 4.248434\n3.756036 3.756036 -4.248434\nHo Ni B\n4 4 16\ndirect\n0.797407 0.797407 0.000000 Ho\n0.202593 0.202593 0.000000 Ho\n0.750000 0.250000 0.500000 Ho\n0.250000 0.750000 0.500000 Ho\n0.271423 0.500000 0.771423 Ni\n0.728577 0.500000 0.228577 Ni\n0.500000 0.728577 0.228577 Ni\n0.500000 0.271423 0.771423 Ni\n0.275213 0.111561 0.386774 B\n0.724787 0.888439 0.613226 B\n0.275213 0.888439 0.163652 B\n0.724787 0.111561 0.836348 B\n0.111561 0.724787 0.836348 B\n0.888439 0.275213 0.163652 B\n0.111561 0.275213 0.386774 B\n0.888439 0.724787 0.613226 B\n0.113879 0.113879 0.533342 B\n0.580537 0.580537 0.466658 B\n0.113879 0.580537 0.000000 B\n0.580537 0.113879 0.000000 B\n0.886121 0.886121 0.466658 B\n0.419463 0.419463 0.533342 B\n0.886121 0.419463 0.000000 B\n0.419463 0.886121 0.000000 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ho",
"Ni",
"B"
],
"chemical_system": "B-Ho-Ni",
"density": 7.39361401813775,
"density_atomic": 0.10010663940409523,
"volume": 239.7443380665338,
"volume_molar": 6.015725626040386,
"formula_full": "Ho4 Ni4 B16",
"formula_reduced": "HoNiB4",
"formula_anonymous": "ABC4",
"energy": -162.21802373,
"energy_per_atom": -6.759084322083333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -162.21802373,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.83e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:05.101000Z",
"spacegroup": 139
}
]
}