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"decomposes_to": null,
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"energy_uncorrected": -296.36793496,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 24.0000415,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:36.280000Z",
"spacegroup": 48
},
{
"id": "mp-1516655",
"created_at": "2022-09-04T14:46:23.710635Z",
"structure_string": "Ba4 Ce4 Eu4 Hf4 O24\n1.0\n8.597727 0.000000 0.000000\n0.000000 8.613079 0.000000\n0.000000 0.000000 8.584133\nBa Ce Eu Hf O\n4 4 4 4 24\ndirect\n0.000000 -0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.500000 Ba\n0.750000 0.750000 0.750000 Ce\n0.250000 0.250000 0.750000 Ce\n0.250000 0.750000 0.250000 Ce\n0.750000 0.250000 0.250000 Ce\n0.000000 0.500000 0.500000 Eu\n0.500000 0.000000 0.500000 Eu\n0.500000 0.000000 0.000000 Eu\n0.000000 0.500000 0.000000 Eu\n0.250000 0.250000 0.250000 Hf\n0.750000 0.750000 0.250000 Hf\n0.750000 0.250000 0.750000 Hf\n0.250000 0.750000 0.750000 Hf\n0.012736 0.213369 0.280135 O\n0.987264 0.786631 0.280135 O\n0.987264 0.213369 0.719865 O\n0.012736 0.786631 0.719865 O\n0.290001 0.013535 0.199685 O\n0.290001 0.986465 0.800315 O\n0.709999 0.986465 0.199685 O\n0.709999 0.013535 0.800315 O\n0.201993 0.293244 0.013267 O\n0.798007 0.293244 0.986733 O\n0.201993 0.706756 0.986733 O\n0.798007 0.706756 0.013267 O\n0.487264 0.286631 0.219865 O\n0.512736 0.713369 0.219865 O\n0.512736 0.286631 0.780135 O\n0.487264 0.713369 0.780135 O\n0.209999 0.486465 0.300315 O\n0.209999 0.513535 0.699685 O\n0.790001 0.513535 0.300315 O\n0.790001 0.486465 0.699685 O\n0.298007 0.206756 0.486733 O\n0.701993 0.206756 0.513267 O\n0.298007 0.793244 0.513267 O\n0.701993 0.793244 0.486733 O\n",
"nsites": 40,
"nelements": 5,
"elements": [
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"Ce",
"Eu",
"Hf",
"O"
],
"chemical_system": "Ba-Ce-Eu-Hf-O",
"density": 7.354911687394644,
"density_atomic": 0.06292474609673304,
"volume": 635.6799587003298,
"volume_molar": 9.570385474010934,
"formula_full": "Ba4 Ce4 Eu4 Hf4 O24",
"formula_reduced": "BaCeEuHfO6",
"formula_anonymous": "ABCDE6",
"energy": -384.86684374,
"energy_per_atom": -9.6216710935,
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"band_gap": 0.0,
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"is_magnetic": true,
"total_magnetization": 21.8392475,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:36.154000Z",
"spacegroup": 48
}
]
}