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S\n0.643763 0.865688 0.155416 S\n0.141259 0.364761 0.150654 S\n0.142991 0.864089 0.154786 S\n0.644084 0.383934 0.653435 S\n0.642882 0.885116 0.650874 S\n0.142849 0.383931 0.653903 S\n0.143195 0.885522 0.650646 S\n0.106596 0.112441 0.346075 S\n0.105546 0.614634 0.345348 S\n0.606548 0.112280 0.346233 S\n0.605455 0.614819 0.344936 S\n0.858741 0.364761 0.150654 S\n0.857009 0.864089 0.154786 S\n0.354718 0.363497 0.152708 S\n0.356237 0.865688 0.155416 S\n0.893353 0.137068 0.846192 S\n0.894571 0.636130 0.845182 S\n0.393184 0.134568 0.846304 S\n0.393207 0.635165 0.846251 S\n0.893404 0.112441 0.346075 S\n0.894454 0.614634 0.345348 S\n0.393452 0.112280 0.346233 S\n0.394545 0.614819 0.344936 S\n0.857151 0.383931 0.653903 S\n0.856805 0.885522 0.650646 S\n0.355916 0.383934 0.653435 S\n0.357118 0.885116 0.650874 S\n","nsites":125,"nelements":3,"elements":["Li","P","S"],"chemical_system":"Li-P-S","density":1.7430112429338835,"density_atomic":0.04711732560552785,"volume":2652.9519320879044,"volume_molar":12.781159971637859,"formula_full":"Li48 P16 S61","formula_reduced":"Li48P16S61","formula_anonymous":"A16B48C61","energy":-576.32491426,"energy_per_atom":-4.61059931408,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-545.64191426,"band_gap":2.2955,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0003323,"is_theoretical":true,"updated_at":"2021-11-28T01:39:20.886000Z","spacegroup":6}]}