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0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.333333 0.666667 0.402896 O\n0.666667 0.333333 0.597104 O\n0.666667 0.333333 0.902896 O\n0.333333 0.666667 0.097104 O\n","nsites":8,"nelements":3,"elements":["Na","Ni","O"],"chemical_system":"Na-Ni-O","density":4.539624852503387,"density_atomic":0.09619207000710096,"volume":83.16693880700805,"volume_molar":6.260537650926361,"formula_full":"Na2 Ni2 O4","formula_reduced":"NaNiO2","formula_anonymous":"ABC2","energy":-44.47537833,"energy_per_atom":-5.55942229125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-36.64537833,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.005004,"is_theoretical":true,"updated_at":"2021-11-28T01:34:55.107000Z","spacegroup":194}]}