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{
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{
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{
"id": "mp-1213104",
"created_at": "2022-09-04T14:45:33.518758Z",
"structure_string": "Cs4 Sr4 Br12\n1.0\n8.254323 0.000000 0.000000\n0.000000 8.618996 0.000000\n0.000000 0.000000 11.875500\nCs Sr Br\n4 4 12\ndirect\n0.020009 0.436971 0.250000 Cs\n0.979991 0.563029 0.750000 Cs\n0.520009 0.063029 0.750000 Cs\n0.479991 0.936971 0.250000 Cs\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.500000 Sr\n0.297158 0.207376 0.043149 Br\n0.702842 0.792624 0.956851 Br\n0.797158 0.292624 0.956851 Br\n0.702842 0.792624 0.543149 Br\n0.202842 0.707376 0.043149 Br\n0.297158 0.207376 0.456851 Br\n0.202842 0.707376 0.456851 Br\n0.797158 0.292624 0.543149 Br\n0.584290 0.523068 0.250000 Br\n0.415710 0.476932 0.750000 Br\n0.084290 0.976932 0.750000 Br\n0.915710 0.023068 0.250000 Br\n",
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{
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{
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"structure_string": "Eu4 Cu4 O12\n1.0\n3.228509 7.417628 0.000000\n-3.228509 7.417628 0.000000\n0.000000 2.305698 5.867385\nEu Cu O\n4 4 12\ndirect\n0.976420 0.650174 0.205932 Eu\n0.023580 0.349826 0.794068 Eu\n0.349826 0.023580 0.294068 Eu\n0.650174 0.976420 0.705932 Eu\n0.497354 0.673666 0.995834 Cu\n0.502646 0.326334 0.004166 Cu\n0.673666 0.497354 0.495834 Cu\n0.326334 0.502646 0.504166 Cu\n0.665376 0.731228 0.506193 O\n0.707544 0.362492 0.990183 O\n0.334624 0.268772 0.493807 O\n0.012738 0.702718 0.532724 O\n0.987262 0.297282 0.467276 O\n0.297282 0.987262 0.967276 O\n0.292456 0.637508 0.009817 O\n0.637508 0.292456 0.509817 O\n0.702718 0.012738 0.032724 O\n0.362492 0.707544 0.490183 O\n0.268772 0.334624 0.993807 O\n0.731228 0.665376 0.006193 O\n",
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{
"id": "mp-1187359",
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{
"id": "mp-1018644",
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"structure_string": "Y1 B1 Pt3\n1.0\n4.344528 0.000000 0.000000\n0.000000 4.344528 0.000000\n0.000000 0.000000 4.344528\nY B Pt\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 B\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n",
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{
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{
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"formula_full": "Ba1 Tl3 Au1",
"formula_reduced": "BaTl3Au",
"formula_anonymous": "ABC3",
"energy": -13.93984093,
"energy_per_atom": -2.787968186,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.93984093,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002098,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:02.736000Z",
"spacegroup": 107
}
]
}