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{
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{
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O\n0.340087 0.457938 0.660367 O\n0.159913 0.542062 0.160367 O\n0.659913 0.957938 0.839633 O\n0.387197 0.627242 0.567528 O\n0.887197 0.872758 0.432472 O\n0.612803 0.127242 0.932472 O\n0.112803 0.372758 0.067528 O\n0.612803 0.372758 0.432472 O\n0.112803 0.127242 0.567528 O\n0.387197 0.872758 0.067528 O\n0.887197 0.627242 0.932472 O\n0.702771 0.909479 0.370337 O\n0.202771 0.590521 0.629663 O\n0.297229 0.409479 0.129663 O\n0.797229 0.090521 0.870337 O\n0.297229 0.090521 0.629663 O\n0.797229 0.409479 0.370337 O\n0.702771 0.590521 0.870337 O\n0.202771 0.909479 0.129663 O\n0.627852 0.187907 0.557768 O\n0.127852 0.312093 0.442232 O\n0.372148 0.687907 0.942232 O\n0.872148 0.812093 0.057768 O\n0.372148 0.812093 0.442232 O\n0.872148 0.687907 0.557768 O\n0.627852 0.312093 0.057768 O\n0.127852 0.187907 0.942232 O\n0.436578 0.146436 0.296485 O\n0.936578 0.353564 0.703515 O\n0.563422 0.646436 0.203515 O\n0.063422 0.853564 0.796485 O\n0.563422 0.853564 0.703515 O\n0.063422 0.646436 0.296485 O\n0.436578 0.353564 0.796485 O\n0.936578 0.146436 0.203515 O\n",
"nsites": 160,
"nelements": 4,
"elements": [
"Rb",
"Mg",
"Si",
"O"
],
"chemical_system": "Mg-O-Rb-Si",
"density": 2.7259424881750096,
"density_atomic": 0.06222181470382804,
"volume": 2571.445412860265,
"volume_molar": 9.678503895563018,
"formula_full": "Rb16 Mg8 Si40 O96",
"formula_reduced": "Rb2MgSi5O12",
"formula_anonymous": "AB2C5D12",
"energy": -1218.6019388,
"energy_per_atom": -7.6162621175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1152.6499388,
"band_gap": 4.1926,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:30.959000Z",
"spacegroup": 61
}
]
}