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Zn\n0.436024 0.917826 0.434899 Zn\n0.435774 0.417675 0.434966 Zn\n0.128962 0.167277 0.435927 Zn\n0.128681 0.667163 0.436289 Zn\n0.564277 0.082797 0.563781 Zn\n0.564098 0.582625 0.564072 Zn\n0.646669 0.626428 0.000600 Fe\n0.352790 0.875940 0.000496 Fe\n0.647069 0.125607 0.000457 Fe\n0.352067 0.376228 0.000562 Fe\n0.045246 0.395602 0.138810 O\n0.046069 0.894354 0.139699 O\n0.180894 0.854642 0.858766 O\n0.180827 0.354278 0.859043 O\n0.959558 0.604264 0.858931 O\n0.960038 0.104636 0.858676 O\n0.814442 0.144420 0.139471 O\n0.814265 0.645057 0.139224 O\n0.311762 0.144316 0.118994 O\n0.310992 0.644235 0.119845 O\n0.437164 0.610332 0.881392 O\n0.439203 0.110527 0.880043 O\n0.680329 0.860931 0.880363 O\n0.680232 0.359556 0.880728 O\n0.568679 0.393712 0.119208 O\n0.569667 0.894269 0.119207 O\n0.926956 0.106895 0.354068 O\n0.926012 0.606664 0.354569 O\n0.281312 0.143354 0.644411 O\n0.281250 0.643174 0.644637 O\n0.719734 0.856738 0.354506 O\n0.719497 0.356686 0.354220 O\n0.072076 0.893081 0.644733 O\n0.072143 0.393285 0.644659 O\n0.456049 0.126988 0.386638 O\n0.455677 0.626972 0.386701 O\n0.843726 0.123997 0.611296 O\n0.843428 0.623752 0.611762 O\n0.543137 0.873747 0.611685 O\n0.543131 0.373930 0.611363 O\n0.157621 0.876844 0.386705 O\n0.157264 0.376864 0.386699 O\n","nsites":52,"nelements":4,"elements":["Ta","Zn","Fe","O"],"chemical_system":"Fe-O-Ta-Zn","density":7.293616950071366,"density_atomic":0.08439850728157698,"volume":616.1246410023992,"volume_molar":7.135364065040223,"formula_full":"Ta8 Zn8 Fe4 O32","formula_reduced":"Ta2Zn2FeO8","formula_anonymous":"AB2C2D8","energy":-431.87801206,"energy_per_atom":-8.30534638576923,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-400.87001206,"band_gap":2.6681000000000004,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":15.998994,"is_theoretical":true,"updated_at":"2021-11-28T01:35:35.894000Z","spacegroup":15}]}