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"updated_at": "2021-11-28T01:34:35.636000Z",
"spacegroup": 62
},
{
"id": "mp-337",
"created_at": "2022-09-04T14:39:40.178711Z",
"structure_string": "Pu2 Be26\n1.0\n0.000000 5.103196 5.103196\n5.103196 0.000000 5.103196\n5.103196 5.103196 0.000000\nPu Be\n2 26\ndirect\n0.250000 0.250000 0.250000 Pu\n0.750000 0.750000 0.750000 Pu\n0.500000 0.500000 0.500000 Be\n0.000000 0.000000 0.000000 Be\n0.209294 0.790706 0.438556 Be\n0.938556 0.290706 0.709294 Be\n0.709294 0.061444 0.938556 Be\n0.938556 0.061444 0.290706 Be\n0.061444 0.938556 0.709294 Be\n0.061444 0.290706 0.938556 Be\n0.709294 0.938556 0.290706 Be\n0.438556 0.790706 0.561444 Be\n0.561444 0.790706 0.209294 Be\n0.790706 0.561444 0.438556 Be\n0.561444 0.209294 0.438556 Be\n0.790706 0.438556 0.209294 Be\n0.438556 0.209294 0.790706 Be\n0.209294 0.561444 0.790706 Be\n0.209294 0.438556 0.561444 Be\n0.709294 0.290706 0.061444 Be\n0.290706 0.938556 0.061444 Be\n0.290706 0.061444 0.709294 Be\n0.938556 0.709294 0.061444 Be\n0.061444 0.709294 0.290706 Be\n0.290706 0.709294 0.938556 Be\n0.438556 0.561444 0.209294 Be\n0.790706 0.209294 0.561444 Be\n0.561444 0.438556 0.790706 Be\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Pu",
"Be"
],
"chemical_system": "Be-Pu",
"density": 4.512529257597863,
"density_atomic": 0.1053419344996407,
"volume": 265.8010803864201,
"volume_molar": 5.716755429453919,
"formula_full": "Pu2 Be26",
"formula_reduced": "PuBe13",
"formula_anonymous": "AB13",
"energy": -128.98885643,
"energy_per_atom": -4.6067448725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -128.98885643,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 11.18888,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:30.118000Z",
"spacegroup": 226
}
]
}