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{
"id": "mp-707454",
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"formula_full": "Li8 H96 N32",
"formula_reduced": "Li(H3N)4",
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"spacegroup": 220
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{
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"created_at": "2022-09-04T14:48:20.888395Z",
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"volume": 1115.1254190601187,
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"formula_full": "Y2 Mg1 Os1",
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{
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{
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{
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{
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{
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{
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{
"id": "mp-1093837",
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"structure_string": "Mn1 Zn2 Rh1\n1.0\n-5.039925 5.315937 7.740277\n5.039925 -5.315937 7.740277\n5.039925 5.315937 -7.740277\nMn Zn Rh\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.260018 0.260018 Zn\n0.000000 0.739982 0.739982 Zn\n0.000000 0.500000 0.500000 Rh\n",
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"total_magnetization": 6.0002689,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:45.355000Z",
"spacegroup": 71
},
{
"id": "mp-1096587",
"created_at": "2022-09-04T14:41:51.955231Z",
"structure_string": "Sc2 Tl1 Pd1\n1.0\n-5.196454 6.268789 8.842698\n5.196454 -6.268789 8.842698\n5.196454 6.268789 -8.842698\nSc Tl Pd\n2 1 1\ndirect\n0.000000 0.229323 0.229323 Sc\n0.000000 0.770677 0.770677 Sc\n0.000000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Tl",
"Pd"
],
"chemical_system": "Pd-Sc-Tl",
"density": 0.5774964352581726,
"density_atomic": 0.003471558336016071,
"volume": 1152.2203036318163,
"volume_molar": 173.47082137501843,
"formula_full": "Sc2 Tl1 Pd1",
"formula_reduced": "Sc2TlPd",
"formula_anonymous": "ABC2",
"energy": -13.13103818,
"energy_per_atom": -3.282759545,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.13103818,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.9974358,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:30.375000Z",
"spacegroup": 71
}
]
}