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"structure_string": "Li36 Mn8 Al4 O32\n1.0\n6.520184 0.000000 0.000000\n0.000000 7.648756 0.000000\n0.000000 0.000000 16.228278\nLi Mn Al O\n36 8 4 32\ndirect\n0.523137 0.532339 0.068837 Li\n0.976863 0.532339 0.068837 Li\n0.250000 0.339009 0.138791 Li\n0.508400 0.105059 0.121433 Li\n0.991600 0.105059 0.121433 Li\n0.750000 0.331784 0.166011 Li\n0.250000 0.801690 0.194706 Li\n0.010162 0.548712 0.209479 Li\n0.489838 0.548712 0.209479 Li\n0.510162 0.048712 0.290521 Li\n0.989838 0.048712 0.290521 Li\n0.750000 0.301690 0.305294 Li\n0.250000 0.831784 0.333989 Li\n0.491600 0.605059 0.378567 Li\n0.008400 0.605059 0.378567 Li\n0.750000 0.839009 0.361209 Li\n0.023137 0.032339 0.431163 Li\n0.476863 0.032339 0.431163 Li\n0.523137 0.967661 0.568837 Li\n0.976863 0.967661 0.568837 Li\n0.250000 0.160991 0.638791 Li\n0.991600 0.394941 0.621433 Li\n0.508400 0.394941 0.621433 Li\n0.750000 0.168216 0.666011 Li\n0.250000 0.698310 0.694706 Li\n0.010162 0.951288 0.709479 Li\n0.489838 0.951288 0.709479 Li\n0.510162 0.451288 0.790521 Li\n0.989838 0.451288 0.790521 Li\n0.750000 0.198310 0.805294 Li\n0.250000 0.668216 0.833989 Li\n0.491600 0.894941 0.878567 Li\n0.008400 0.894941 0.878567 Li\n0.750000 0.660991 0.861209 Li\n0.023137 0.467661 0.931163 Li\n0.476863 0.467661 0.931163 Li\n0.250000 0.772921 0.030498 Mn\n0.750000 0.802365 0.195505 Mn\n0.250000 0.302365 0.304495 Mn\n0.750000 0.272921 0.469502 Mn\n0.250000 0.727079 0.530498 Mn\n0.750000 0.697635 0.695505 Mn\n0.250000 0.197635 0.804495 Mn\n0.750000 0.227079 0.969502 Mn\n0.750000 0.839251 0.000524 Al\n0.250000 0.339251 0.499476 Al\n0.750000 0.660749 0.500524 Al\n0.250000 0.160749 0.999476 Al\n0.470508 0.291815 0.024384 O\n0.029492 0.291815 0.024384 O\n0.250000 0.012717 0.088336 O\n0.250000 0.590560 0.129668 O\n0.750000 0.564431 0.141192 O\n0.750000 0.967938 0.093070 O\n0.999120 0.277685 0.224240 O\n0.500880 0.277685 0.224240 O\n0.499120 0.777685 0.275760 O\n0.000880 0.777685 0.275760 O\n0.250000 0.467938 0.406930 O\n0.250000 0.064431 0.358808 O\n0.750000 0.090560 0.370332 O\n0.750000 0.512717 0.411664 O\n0.970508 0.791815 0.475616 O\n0.529492 0.791815 0.475616 O\n0.470508 0.208185 0.524384 O\n0.029492 0.208185 0.524384 O\n0.250000 0.487283 0.588336 O\n0.250000 0.909440 0.629668 O\n0.750000 0.935569 0.641192 O\n0.750000 0.532062 0.593070 O\n0.999120 0.222315 0.724240 O\n0.500880 0.222315 0.724240 O\n0.499120 0.722315 0.775760 O\n0.000880 0.722315 0.775760 O\n0.250000 0.032062 0.906930 O\n0.250000 0.435569 0.858808 O\n0.750000 0.409440 0.870332 O\n0.750000 0.987283 0.911664 O\n0.970508 0.708185 0.975616 O\n0.529492 0.708185 0.975616 O\n",
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"elements": [
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],
"chemical_system": "Al-Li-Mn-O",
"density": 2.686339884022002,
"density_atomic": 0.09884777306522219,
"volume": 809.3252636780602,
"volume_molar": 6.092338323116742,
"formula_full": "Li36 Mn8 Al4 O32",
"formula_reduced": "Li9Mn2AlO8",
"formula_anonymous": "AB2C8D9",
"energy": -491.06504545,
"energy_per_atom": -6.138313068125,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -455.73704545,
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"updated_at": "2021-11-28T01:34:27.238000Z",
"spacegroup": 62
},
{
"id": "mp-1396276",
"created_at": "2022-09-04T14:39:31.545305Z",
"structure_string": "Ca1 La2 Sn1 O6\n1.0\n5.077375 -2.999995 0.000000\n5.077375 2.999995 0.000000\n3.304810 0.000000 4.884458\nCa La Sn O\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 Ca\n0.763678 0.763678 0.763678 La\n0.236322 0.236322 0.236322 La\n0.000000 0.000000 0.000000 Sn\n0.782960 0.345383 0.128100 O\n0.128100 0.782960 0.345383 O\n0.345383 0.128100 0.782960 O\n0.217040 0.654617 0.871900 O\n0.654617 0.871900 0.217040 O\n0.871900 0.217040 0.654617 O\n",
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],
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"density_atomic": 0.06720380353938364,
"volume": 148.80110162425063,
"volume_molar": 8.961011792243019,
"formula_full": "Ca1 La2 Sn1 O6",
"formula_reduced": "CaLa2SnO6",
"formula_anonymous": "ABC2D6",
"energy": -78.0596328,
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"total_magnetization": 6e-06,
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"updated_at": "2021-11-28T01:34:32.440000Z",
"spacegroup": 148
},
{
"id": "mp-1232330",
"created_at": "2022-09-04T14:39:30.243948Z",
"structure_string": "Na2 Cu1 Ag2 S2 O2\n1.0\n-1.963009 1.963009 9.650369\n1.963009 -1.963009 9.650369\n1.963009 1.963009 -9.650369\nNa Cu Ag S O\n2 1 2 2 2\ndirect\n0.575702 0.575702 0.000000 Na\n0.424298 0.424298 0.000000 Na\n0.000000 0.000000 0.000000 Cu\n0.250000 0.750000 0.500000 Ag\n0.750000 0.250000 0.500000 Ag\n0.837561 0.837561 0.000000 S\n0.162439 0.162439 0.000000 S\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n",
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],
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"volume": 148.7470949203237,
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"formula_full": "Na2 Cu1 Ag2 S2 O2",
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"updated_at": "2021-11-28T01:34:41.085000Z",
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}
]
}