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O\n0.532362 0.807805 0.837513 O\n0.282222 0.179192 0.129659 O\n0.690056 0.234921 0.834402 O\n0.347063 0.017440 0.373222 O\n","nsites":72,"nelements":4,"elements":["Li","Mo","P","O"],"chemical_system":"Li-Mo-O-P","density":2.874136159950611,"density_atomic":0.0743971637171488,"volume":967.7788292271115,"volume_molar":8.09458379743565,"formula_full":"Li4 Mo4 P16 O48","formula_reduced":"LiMo(PO3)4","formula_anonymous":"ABC4D12","energy":-558.12109192,"energy_per_atom":-7.751681832222222,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-512.33709192,"band_gap":3.8685,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":11.9996032,"is_theoretical":true,"updated_at":"2021-11-28T01:36:26.252000Z","spacegroup":14},{"id":"mp-755502","created_at":"2022-09-04T14:44:09.840291Z","structure_string":"Mn6 O2 F10\n1.0\n4.867542 0.000000 0.000000\n0.295322 5.791820 0.000000\n0.143167 0.420119 8.191541\nMn O F\n6 2 10\ndirect\n0.469556 0.345181 0.687413 Mn\n0.530444 0.654819 0.312587 Mn\n0.500000 0.000000 0.000000 Mn\n0.996831 0.166240 0.336586 Mn\n0.000000 0.500000 0.000000 Mn\n0.003169 0.833760 0.663414 Mn\n0.706685 0.715845 0.084834 O\n0.293315 0.284155 0.915166 O\n0.793416 0.214373 0.104696 F\n0.802616 0.865243 0.433405 F\n0.814474 0.528384 0.767898 F\n0.690046 0.030375 0.775414 F\n0.687290 0.360761 0.450214 F\n0.309954 0.969625 0.224586 F\n0.312710 0.639239 0.549786 F\n0.185526 0.471616 0.232102 F\n0.206584 0.785627 0.895304 F\n0.197384 0.134757 0.566595 F\n","nsites":18,"nelements":3,"elements":["Mn","O","F"],"chemical_system":"F-Mn-O","density":3.9663562837555455,"density_atomic":0.07794389993262603,"volume":230.9353267614147,"volume_molar":7.726250245632413,"formula_full":"Mn6 O2 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0.651098 Cu\n0.555700 0.607732 0.870988 Cu\n0.458828 0.091256 0.838969 Sb\n0.041172 0.091256 0.338969 Sb\n0.085350 0.599038 0.142374 Sb\n0.958828 0.908744 0.661031 Sb\n0.914650 0.400962 0.857626 Sb\n0.585350 0.400962 0.357626 Sb\n0.414650 0.599038 0.642374 Sb\n0.541172 0.908744 0.161031 Sb\n0.238044 0.016520 0.376759 O\n0.004607 0.666049 0.594152 O\n0.573893 0.194119 0.463888 O\n0.073893 0.805881 0.036112 O\n0.261956 0.016520 0.876759 O\n0.761956 0.983480 0.623241 O\n0.097271 0.105954 0.609948 O\n0.885711 0.511163 0.144524 O\n0.614289 0.511163 0.644524 O\n0.879388 0.312266 0.714568 O\n0.379388 0.687734 0.785432 O\n0.114289 0.488837 0.855476 O\n0.902729 0.894046 0.390052 O\n0.519755 0.863790 0.309819 O\n0.263595 0.428314 0.595863 O\n0.236405 0.428314 0.095863 O\n0.019755 0.136210 0.190181 O\n0.385711 0.488837 0.355476 O\n0.480245 0.136210 0.690181 O\n0.426107 0.805881 0.536112 O\n0.495393 0.666049 0.094152 O\n0.120612 0.687734 0.285432 O\n0.738044 0.983480 0.123241 O\n0.402729 0.105954 0.109948 O\n0.926107 0.194119 0.963888 O\n0.763595 0.571686 0.904137 O\n0.995393 0.333951 0.405848 O\n0.504607 0.333951 0.905848 O\n0.597271 0.894046 0.890052 O\n0.736405 0.571686 0.404137 O\n0.620612 0.312266 0.214568 O\n0.980245 0.863790 0.809819 O\n","nsites":52,"nelements":4,"elements":["Ca","Cu","Sb","O"],"chemical_system":"Ca-Cu-O-Sb","density":4.611679213303414,"density_atomic":0.06702214165843001,"volume":775.8630015885126,"volume_molar":8.985300396234857,"formula_full":"Ca4 Cu8 Sb8 O32","formula_reduced":"CaCu2(SbO4)2","formula_anonymous":"AB2C2D8","energy":-320.33714412,"energy_per_atom":-6.160329694615385,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-298.35314412,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.0051267,"is_theoretical":true,"updated_at":"2021-11-28T01:36:27.899000Z","spacegroup":14}]}