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{
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{
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{
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"structure_string": "Ho2 Cr4 O12\n1.0\n5.118403 0.000000 0.000000\n0.000000 5.453247 0.000000\n0.000000 0.000000 7.441398\nHo Cr O\n2 4 12\ndirect\n0.016785 0.662010 0.000000 Ho\n0.516785 0.337990 0.500000 Ho\n0.023536 0.220617 0.755751 Cr\n0.023536 0.220617 0.244249 Cr\n0.523536 0.779383 0.255751 Cr\n0.523536 0.779383 0.744249 Cr\n0.095004 0.221982 0.500000 O\n0.194534 0.939200 0.805209 O\n0.194534 0.939200 0.194791 O\n0.278622 0.456290 0.788274 O\n0.278622 0.456290 0.211726 O\n0.415108 0.739518 0.500000 O\n0.595004 0.778018 0.000000 O\n0.694534 0.060800 0.305209 O\n0.694534 0.060800 0.694791 O\n0.778622 0.543710 0.711726 O\n0.778622 0.543710 0.288274 O\n0.915108 0.260482 0.000000 O\n",
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{
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{
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"id": "mp-1093664",
"created_at": "2022-09-04T14:44:09.144332Z",
"structure_string": "Sr2 Ag1 Pb1\n1.0\n-6.448588 6.912428 9.764245\n6.448588 -6.912428 9.764245\n6.448588 6.912428 -9.764245\nSr Ag Pb\n2 1 1\ndirect\n0.000000 0.246414 0.246414 Sr\n0.000000 0.753586 0.753586 Sr\n0.000000 0.000000 0.000000 Ag\n0.000000 0.500000 0.500000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Ag",
"Pb"
],
"chemical_system": "Ag-Pb-Sr",
"density": 0.46765366598601815,
"density_atomic": 0.0022975558674899342,
"volume": 1740.9805161212362,
"volume_molar": 262.11074321248833,
"formula_full": "Sr2 Ag1 Pb1",
"formula_reduced": "Sr2AgPb",
"formula_anonymous": "ABC2",
"energy": -5.85567258,
"energy_per_atom": -1.463918145,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.85567258,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.000048,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:31.877000Z",
"spacegroup": 71
}
]
}