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0.668155 0.591212 K\n0.000000 0.331845 0.091212 K\n0.668155 0.668155 0.091212 K\n0.331845 0.000000 0.408788 K\n0.000000 0.000000 0.000000 K\n0.333333 0.666667 0.750000 K\n0.666667 0.333333 0.250000 K\n0.666667 0.333333 0.750000 K\n0.333333 0.666667 0.250000 K\n0.668155 0.668155 0.408788 K\n0.668155 0.000000 0.908788 K\n0.000000 0.668155 0.908788 K\n0.000000 0.331845 0.408788 K\n0.668155 0.000000 0.591212 K\n0.331845 0.331845 0.908788 K\n0.000000 0.000000 0.750000 Tb\n0.333333 0.666667 0.000000 Tb\n0.666667 0.333333 0.500000 Tb\n0.666667 0.333333 0.000000 Tb\n0.333333 0.666667 0.500000 Tb\n0.000000 0.000000 0.250000 Tb\n0.658655 0.658655 0.857048 Si\n0.341345 0.000000 0.857048 Si\n0.000000 0.341345 0.857048 Si\n0.000000 0.658655 0.357048 Si\n0.341345 0.000000 0.642952 Si\n0.341345 0.341345 0.357048 Si\n0.658655 0.000000 0.357048 Si\n0.341345 0.341345 0.142952 Si\n0.000000 0.658655 0.142952 Si\n0.000000 0.341345 0.642952 Si\n0.658655 0.658655 0.642952 Si\n0.658655 0.000000 0.142952 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O\n0.523086 0.678148 0.592045 O\n0.321852 0.476914 0.407955 O\n0.321852 0.844938 0.592045 O\n0.678148 0.523086 0.907955 O\n0.155062 0.678148 0.407955 O\n0.523086 0.844938 0.407955 O\n0.476914 0.155062 0.907955 O\n0.844938 0.321852 0.907955 O\n0.155062 0.476914 0.592045 O\n","nsites":78,"nelements":4,"elements":["K","Tb","Si","O"],"chemical_system":"K-O-Si-Tb","density":3.5279574473288946,"density_atomic":0.06215215599910282,"volume":1254.9846219514243,"volume_molar":9.68935133977803,"formula_full":"K18 Tb6 Si12 O42","formula_reduced":"K3TbSi2O7","formula_anonymous":"AB2C3D7","energy":-560.9013235900001,"energy_per_atom":-7.191042610128206,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-532.04732359,"band_gap":3.688,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0056939,"is_theoretical":false,"updated_at":"2021-11-28T01:36:41.407000Z","spacegroup":193}]}