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P\n0.255188 0.447514 0.531754 P\n0.744812 0.552486 0.468246 P\n0.956922 0.043078 0.250000 P\n0.447514 0.255188 0.031754 P\n0.552486 0.744812 0.968246 P\n0.318927 0.617426 0.464616 O\n0.556666 0.904741 0.770688 O\n0.873514 0.982394 0.705348 O\n0.982394 0.873514 0.205348 O\n0.017606 0.126486 0.794652 O\n0.126486 0.017606 0.294652 O\n0.443334 0.095259 0.229312 O\n0.249834 0.407427 0.070723 O\n0.452209 0.188576 0.889516 O\n0.617426 0.318927 0.964616 O\n0.053003 0.770660 0.922022 O\n0.547791 0.811424 0.110484 O\n0.407427 0.249834 0.570723 O\n0.188576 0.452209 0.389516 O\n0.095259 0.443334 0.729312 O\n0.770660 0.053003 0.422022 O\n0.229340 0.946997 0.577978 O\n0.681073 0.382574 0.535384 O\n0.811424 0.547791 0.610484 O\n0.592573 0.750166 0.429277 O\n0.904741 0.556666 0.270688 O\n0.946997 0.229340 0.077978 O\n0.382574 0.681073 0.035384 O\n0.750166 0.592573 0.929277 O\n","nsites":40,"nelements":4,"elements":["Li","Cr","P","O"],"chemical_system":"Cr-Li-O-P","density":3.0481413011781493,"density_atomic":0.08960226474222752,"volume":446.41728772229243,"volume_molar":6.720969360902663,"formula_full":"Li6 Cr4 P6 O24","formula_reduced":"Li3Cr2(PO4)3","formula_anonymous":"A2B3C3D12","energy":-306.79058079,"energy_per_atom":-7.669764519749999,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-282.30658079,"band_gap":2.6652,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":11.9990367,"is_theoretical":true,"updated_at":"2021-11-28T01:37:03.880000Z","spacegroup":15}]}