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F4","formula_reduced":"Li2MnVP2(O4F)2","formula_anonymous":"ABC2D2E2F8","energy":-239.99620262,"energy_per_atom":-7.499881331875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-220.42020262,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.0002821,"is_theoretical":true,"updated_at":"2021-11-28T01:35:51.969000Z","spacegroup":2},{"id":"mp-776481","created_at":"2022-09-04T14:46:41.673984Z","structure_string":"Li6 Mn3 V3 P6 O24 F6\n1.0\n5.229687 0.000000 0.000000\n1.789412 10.262150 0.000000\n1.271585 1.882581 10.269159\nLi Mn V P O F\n6 3 3 6 24 6\ndirect\n0.995790 0.919619 0.731092 Li\n0.668674 0.413776 0.601285 Li\n0.334781 0.746036 0.934461 Li\n0.666531 0.253219 0.065449 Li\n0.332627 0.587712 0.397908 Li\n0.003115 0.079902 0.268963 Li\n0.501841 0.999836 0.499174 Mn\n0.668610 0.333355 0.332686 Mn\n0.166435 0.333361 0.833498 Mn\n0.996940 0.998951 0.001423 V\n0.831753 0.667540 0.167150 V\n0.333376 0.666847 0.666233 V\n0.816202 0.627477 0.865612 P\n0.850509 0.705562 0.467807 P\n0.481030 0.961935 0.200310 P\n0.514190 0.038656 0.800586 P\n0.149856 0.293793 0.531233 P\n0.187169 0.372774 0.134526 P\n0.740967 0.974894 0.886596 O\n0.974395 0.677734 0.332056 O\n0.885453 0.477326 0.866769 O\n0.780968 0.854882 0.467708 O\n0.921734 0.359242 0.444713 O\n0.944729 0.299137 0.183076 O\n0.591557 0.691404 0.778668 O\n0.610131 0.631805 0.514582 O\n0.692913 0.656578 0.000911 O\n0.547615 0.813579 0.200437 O\n0.635989 0.007302 0.665097 O\n0.274668 0.964844 0.849986 O\n0.721411 0.035418 0.151420 O\n0.360574 0.992778 0.336230 O\n0.446494 0.188509 0.799639 O\n0.306093 0.339846 0.999213 O\n0.390815 0.368412 0.481805 O\n0.414348 0.307398 0.221521 O\n0.057268 0.700531 0.818794 O\n0.075383 0.641232 0.554647 O\n0.219368 0.144894 0.533224 O\n0.119720 0.521031 0.132981 O\n0.029715 0.326385 0.666567 O\n0.254731 0.025483 0.114070 O\n0.926193 0.193840 0.940013 F\n0.748412 0.131389 0.395759 F\n0.596021 0.540045 0.267534 F\n0.407967 0.471338 0.726622 F\n0.258506 0.861735 0.606829 F\n0.066437 0.800665 0.063135 F\n","nsites":48,"nelements":6,"elements":["Li","Mn","V","P","O","F"],"chemical_system":"F-Li-Mn-O-P-V","density":3.1428774915137576,"density_atomic":0.08709481559169097,"volume":551.1235045841156,"volume_molar":6.9144652515626035,"formula_full":"Li6 Mn3 V3 P6 O24 F6","formula_reduced":"Li2MnVP2(O4F)2","formula_anonymous":"ABC2D2E2F8","energy":-359.62629055,"energy_per_atom":-7.4922143864583335,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-330.26229055,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":16.0017608,"is_theoretical":true,"updated_at":"2021-11-28T01:37:42.545000Z","spacegroup":1}]}