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{
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{
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],
"chemical_system": "Cr-La-Mg-O-Sb",
"density": 5.77894738013088,
"density_atomic": 0.08038016410458403,
"volume": 248.81760597026963,
"volume_molar": 7.4920732335959,
"formula_full": "La2 Mg2 Cr2 Sb2 O12",
"formula_reduced": "LaMgCrSbO6",
"formula_anonymous": "ABCDE6",
"energy": -151.85558892999998,
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"energy_uncorrected": -139.61358893,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:34:54.455000Z",
"spacegroup": 7
},
{
"id": "mp-1280895",
"created_at": "2022-09-04T14:40:32.593879Z",
"structure_string": "Sr2 La2 Fe2 Co2 O12\n1.0\n2.750827 -4.764577 0.000001\n8.258562 4.768088 0.001817\n-0.000328 -3.176576 4.492088\nSr La Fe Co O\n2 2 2 2 12\ndirect\n0.875842 0.372316 0.248317 Sr\n0.374341 0.877162 0.251319 Sr\n0.122867 0.631873 0.754262 La\n0.628077 0.118233 0.743846 La\n0.750332 0.749163 0.499347 Fe\n0.250330 0.249562 0.499329 Fe\n0.501111 0.497012 0.997774 Co\n0.000036 0.000737 0.999928 Co\n0.873260 0.375801 0.751394 O\n0.366526 0.878339 0.755592 O\n0.633091 0.121835 0.245957 O\n0.127474 0.625285 0.248910 O\n0.375349 0.375800 0.751390 O\n0.877884 0.878338 0.755593 O\n0.120952 0.121836 0.245958 O\n0.623615 0.625282 0.248911 O\n0.623649 0.625273 0.752708 O\n0.122115 0.122024 0.755777 O\n0.375665 0.375652 0.248670 O\n0.877486 0.878478 0.245022 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
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"La",
"Fe",
"Co",
"O"
],
"chemical_system": "Co-Fe-La-O-Sr",
"density": 6.1618857621870955,
"density_atomic": 0.08485647817078239,
"volume": 235.6920818673142,
"volume_molar": 7.096854465112049,
"formula_full": "Sr2 La2 Fe2 Co2 O12",
"formula_reduced": "SrLaFeCoO6",
"formula_anonymous": "ABCDE6",
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"is_stable": null,
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"energy_uncorrected": -136.10709328,
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"updated_at": "2021-11-28T01:35:01.329000Z",
"spacegroup": 160
},
{
"id": "mp-1517968",
"created_at": "2022-09-04T14:40:29.972790Z",
"structure_string": "Sr1 Cr1 Sn1 W1 O6\n1.0\n0.000000 -3.993223 -3.993223\n3.993223 -0.000000 -3.993223\n3.993223 -3.993223 -0.000000\nSr Cr Sn W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n-0.000000 0.000000 0.000000 Cr\n0.250000 0.250000 0.250000 Sn\n0.500000 0.500000 0.500000 W\n0.749087 0.250913 0.250913 O\n0.250913 0.749087 0.749087 O\n0.749087 0.250913 0.749087 O\n0.250913 0.749087 0.250913 O\n0.749087 0.749087 0.250913 O\n0.250913 0.250913 0.749087 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
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"Cr",
"Sn",
"W",
"O"
],
"chemical_system": "Cr-O-Sn-Sr-W",
"density": 7.017167484718439,
"density_atomic": 0.07852343919182994,
"volume": 127.35050964299155,
"volume_molar": 7.6692269492783245,
"formula_full": "Sr1 Cr1 Sn1 W1 O6",
"formula_reduced": "SrCrSnWO6",
"formula_anonymous": "ABCDE6",
"energy": -80.24403687,
"energy_per_atom": -8.024403687,
"energy_above_hull": null,
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"energy_uncorrected": -69.68503687,
"band_gap": 0.0,
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"total_magnetization": 2.0000006,
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"updated_at": "2021-11-28T01:35:01.477000Z",
"spacegroup": 216
}
]
}