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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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{
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"formula_full": "Mn2 Cu1 Sb1",
"formula_reduced": "Mn2CuSb",
"formula_anonymous": "ABC2",
"energy": -25.62785377,
"energy_per_atom": -6.4069634425,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.43585377,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.773776,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:36.417000Z",
"spacegroup": 216
},
{
"id": "mp-22662",
"created_at": "2022-09-04T14:39:16.015502Z",
"structure_string": "Ti2 Ga2 Pt2\n1.0\n2.208009 -3.824384 0.000000\n2.208009 3.824384 0.000000\n0.000000 0.000000 5.515720\nTi Ga Pt\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 Ti\n0.333333 0.666667 0.250000 Ga\n0.666667 0.333333 0.750000 Ga\n0.333333 0.666667 0.750000 Pt\n0.666667 0.333333 0.250000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ti",
"Ga",
"Pt"
],
"chemical_system": "Ga-Pt-Ti",
"density": 11.147470291916063,
"density_atomic": 0.0644105060597006,
"volume": 93.15250518973939,
"volume_molar": 9.349624973320685,
"formula_full": "Ti2 Ga2 Pt2",
"formula_reduced": "TiGaPt",
"formula_anonymous": "ABC",
"energy": -38.87121207,
"energy_per_atom": -6.478535345,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.87121207,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0074389,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:36.509000Z",
"spacegroup": 194
}
]
}