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"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -96.64375607,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 12.2068791,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:22.777000Z",
"spacegroup": 193
},
{
"id": "mp-1106034",
"created_at": "2022-09-04T14:41:17.111735Z",
"structure_string": "Th6 Tl10\n1.0\n5.245949 4.226236 0.000000\n-5.245949 4.226236 0.000000\n0.000000 0.000000 10.465568\nTh Tl\n6 10\ndirect\n0.614413 0.614413 0.250000 Th\n0.385587 0.385587 0.750000 Th\n0.793539 0.206461 0.500000 Th\n0.793539 0.206461 0.000000 Th\n0.206461 0.793539 0.500000 Th\n0.206461 0.793539 0.000000 Th\n0.005202 0.005202 0.250000 Tl\n0.994798 0.994798 0.750000 Tl\n0.299427 0.299427 0.045341 Tl\n0.700573 0.700573 0.954659 Tl\n0.299427 0.299427 0.454659 Tl\n0.700573 0.700573 0.545341 Tl\n0.056235 0.500858 0.250000 Tl\n0.499142 0.943765 0.750000 Tl\n0.943765 0.499142 0.750000 Tl\n0.500858 0.056235 0.250000 Tl\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Th",
"Tl"
],
"chemical_system": "Th-Tl",
"density": 12.295307631699611,
"density_atomic": 0.03447858021775739,
"volume": 464.0562314036229,
"volume_molar": 17.466324662923434,
"formula_full": "Th6 Tl10",
"formula_reduced": "Th3Tl5",
"formula_anonymous": "A3B5",
"energy": -70.45819805,
"energy_per_atom": -4.403637378125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -70.45819805,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0131178,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:10.830000Z",
"spacegroup": 63
}
]
}