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{
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{
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"energy_per_atom": -7.54430563888889,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -132.9095015,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002384,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:37.012000Z",
"spacegroup": 15
},
{
"id": "mp-1028366",
"created_at": "2022-09-04T14:44:21.583875Z",
"structure_string": "K1 Mg14 Ni1\n1.0\n6.379521 0.000000 -0.000000\n-3.189761 5.524827 -0.000000\n0.000000 0.000000 10.525764\nK Mg Ni\n1 14 1\ndirect\n0.166667 0.333333 0.625000 K\n0.155678 0.827838 0.125000 Mg\n0.173315 0.836657 0.625000 Mg\n0.672162 0.344322 0.125000 Mg\n0.663343 0.326685 0.625000 Mg\n0.672162 0.827838 0.125000 Mg\n0.663343 0.836657 0.625000 Mg\n0.329739 0.170261 0.346020 Mg\n0.329739 0.170261 0.903980 Mg\n0.329739 0.659479 0.346020 Mg\n0.329739 0.659479 0.903980 Mg\n0.840521 0.170261 0.346020 Mg\n0.840521 0.170261 0.903980 Mg\n0.833333 0.666667 0.384375 Mg\n0.833333 0.666667 0.865625 Mg\n0.166667 0.333333 0.125000 Ni\n",
"nsites": 16,
"nelements": 3,
"elements": [
"K",
"Mg",
"Ni"
],
"chemical_system": "K-Mg-Ni",
"density": 1.960758012857283,
"density_atomic": 0.043128027869334486,
"volume": 370.9884451121993,
"volume_molar": 13.96340397999499,
"formula_full": "K1 Mg14 Ni1",
"formula_reduced": "KMg14Ni",
"formula_anonymous": "ABC14",
"energy": -27.07150767,
"energy_per_atom": -1.691969229375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.07150767,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002502,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:29.873000Z",
"spacegroup": 187
}
]
}