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{
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{
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{
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{
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"energy_uncorrected": -284.91628321,
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"updated_at": "2021-11-28T01:39:37.666000Z",
"spacegroup": 29
},
{
"id": "mp-1272796",
"created_at": "2022-09-04T14:48:26.140900Z",
"structure_string": "Ba1 La1 Mn1 Ru1 O6\n1.0\n2.887344 2.882967 4.025616\n2.887342 -2.882961 -4.025619\n2.887348 2.905269 -4.073815\nBa La Mn Ru O\n1 1 1 1 6\ndirect\n0.250927 0.999583 0.749488 Ba\n0.750680 0.981488 0.267833 La\n0.502666 0.496007 0.001328 Mn\n0.000995 0.499956 0.499049 Ru\n0.239871 0.548300 0.211830 O\n0.761227 0.402789 0.835983 O\n0.730589 0.529554 0.286726 O\n0.183721 0.982686 0.286727 O\n0.299658 0.539813 0.680519 O\n0.779667 0.019823 0.680518 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
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"Mn",
"Ru",
"O"
],
"chemical_system": "Ba-La-Mn-O-Ru",
"density": 6.480210809708203,
"density_atomic": 0.07387734661448736,
"volume": 135.35949053750934,
"volume_molar": 8.151539052187694,
"formula_full": "Ba1 La1 Mn1 Ru1 O6",
"formula_reduced": "BaLaMnRuO6",
"formula_anonymous": "ABCDE6",
"energy": -80.65213157000001,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:39:33.854000Z",
"spacegroup": 8
},
{
"id": "mp-1227906",
"created_at": "2022-09-04T14:48:27.144698Z",
"structure_string": "Ba1 La1 Mn1 Sn1 O6\n1.0\n-5.698357 -0.000051 -0.000087\n-0.000086 0.073532 -5.713897\n-2.849259 -4.211697 -2.804075\nBa La Mn Sn O\n1 1 1 1 6\ndirect\n0.752314 0.255850 0.495383 Ba\n0.246817 0.727135 0.506385 La\n0.504204 0.509290 0.991594 Mn\n0.000189 0.999145 0.999629 Sn\n0.761200 0.806993 0.477594 O\n0.235712 0.136470 0.528578 O\n0.283204 0.317759 0.915864 O\n0.230117 0.714797 0.084549 O\n0.800919 0.317766 0.915868 O\n0.685324 0.714794 0.084556 O\n",
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"elements": [
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"La",
"Mn",
"Sn",
"O"
],
"chemical_system": "Ba-La-Mn-O-Sn",
"density": 6.553935305663477,
"density_atomic": 0.07230333408819574,
"volume": 138.30620850488003,
"volume_molar": 8.328994555982968,
"formula_full": "Ba1 La1 Mn1 Sn1 O6",
"formula_reduced": "BaLaMnSnO6",
"formula_anonymous": "ABCDE6",
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"updated_at": "2021-11-28T01:39:08.404000Z",
"spacegroup": 8
}
]
}