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O14","formula_reduced":"Sr2TbGaCu2O7","formula_anonymous":"ABC2D2E7","energy":-172.66420834,"energy_per_atom":-6.64093109,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-163.04620834,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0019399,"is_theoretical":false,"updated_at":"2021-11-28T01:36:36.461000Z","spacegroup":46},{"id":"mp-6362","created_at":"2022-09-04T14:40:28.559214Z","structure_string":"Sr4 Tb2 Ir2 O12\n1.0\n5.890886 0.000000 0.000000\n0.000000 5.833096 0.000000\n0.000000 5.769918 8.280822\nSr Tb Ir O\n4 2 2 12\ndirect\n0.463559 0.759419 0.249163 Sr\n0.963559 0.240581 0.250837 Sr\n0.036441 0.759419 0.749163 Sr\n0.536441 0.240581 0.750837 Sr\n0.500000 0.500000 0.000000 Tb\n0.000000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n0.199727 0.232242 0.038232 O\n0.699727 0.767758 0.461768 O\n0.800273 0.767758 0.961768 O\n0.300273 0.232242 0.538232 O\n0.728554 0.156157 0.040274 O\n0.228554 0.843843 0.459726 O\n0.271446 0.843843 0.959726 O\n0.771446 0.156157 0.540274 O\n0.518546 0.307908 0.265794 O\n0.018546 0.692092 0.234206 O\n0.481454 0.692092 0.734206 O\n0.981454 0.307908 0.765794 O\n","nsites":20,"nelements":4,"elements":["Sr","Tb","Ir","O"],"chemical_system":"Ir-O-Sr-Tb","density":7.264080650669636,"density_atomic":0.07028729079429911,"volume":284.54646315123256,"volume_molar":8.567894269284379,"formula_full":"Sr4 Tb2 Ir2 O12","formula_reduced":"Sr2TbIrO6","formula_anonymous":"ABC2D6","energy":-148.55178245,"energy_per_atom":-7.4275891225,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-140.30778245,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0021052,"is_theoretical":false,"updated_at":"2021-11-28T01:35:00.077000Z","spacegroup":14}]}