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0.452031 O\n0.648189 0.111350 0.547969 O\n0.648189 0.388650 0.047969 O\n0.148189 0.611350 0.952031 O\n0.306371 0.095601 0.405363 O\n0.806371 0.904399 0.594637 O\n0.806371 0.595601 0.094637 O\n0.306371 0.404399 0.905363 O\n0.706171 0.082333 0.313969 O\n0.206171 0.917667 0.686031 O\n0.206171 0.582333 0.186031 O\n0.706171 0.417667 0.813969 O\n0.977997 0.086880 0.227714 O\n0.477997 0.913120 0.772286 O\n0.477997 0.586880 0.272286 O\n0.977997 0.413120 0.727714 O\n0.894262 0.878292 0.305999 O\n0.394262 0.121708 0.694001 O\n0.394262 0.378292 0.194001 O\n0.894262 0.621708 0.805999 O\n","nsites":96,"nelements":4,"elements":["Na","Co","P","O"],"chemical_system":"Co-Na-O-P","density":2.908538810489827,"density_atomic":0.07537493120432712,"volume":1273.633003256245,"volume_molar":7.989580439781922,"formula_full":"Na16 Co8 P16 O56","formula_reduced":"Na2CoP2O7","formula_anonymous":"AB2C2D7","energy":-679.04592819,"energy_per_atom":-7.073395085312501,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-627.46992819,"band_gap":3.3221,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":24.001542,"is_theoretical":false,"updated_at":"2021-11-28T01:34:24.165000Z","spacegroup":33},{"id":"mp-1235188","created_at":"2022-09-04T14:39:34.737748Z","structure_string":"Sr2 Li1 Zr1 Cr1 O6\n1.0\n-2.848400 -2.845116 4.019858\n-3.242326 2.845373 -4.304864\n2.844197 -2.844660 -4.022481\nSr Li Zr Cr O\n2 1 1 1 6\ndirect\n0.525614 0.288903 0.762957 Sr\n0.587633 0.882138 0.294183 Sr\n0.260479 0.391452 0.130339 Li\n0.007780 0.512057 0.503993 Zr\n0.970948 0.956743 0.985556 Cr\n0.985589 0.225153 0.239197 O\n0.980121 0.729178 0.749483 O\n0.478735 0.225994 0.239552 O\n0.498278 0.727402 0.748970 O\n0.979692 0.728379 0.229973 O\n0.985547 0.225458 0.746747 O\n","nsites":11,"nelements":5,"elements":["Sr","Li","Zr","Cr","O"],"chemical_system":"Cr-Li-O-Sr-Zr","density":4.860410111178744,"density_atomic":0.07640548706638467,"volume":143.96871772367192,"volume_molar":7.881817119715083,"formula_full":"Sr2 Li1 Zr1 Cr1 O6","formula_reduced":"Sr2LiZrCrO6","formula_anonymous":"ABCD2E6","energy":-85.22466501,"energy_per_atom":-7.747696819090908,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-79.10366501,"band_gap":3.0192,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.9993505,"is_theoretical":true,"updated_at":"2021-11-28T01:34:24.164000Z","spacegroup":160}]}