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O\n","nsites":72,"nelements":3,"elements":["Al","Si","O"],"chemical_system":"Al-O-Si","density":1.7329363349063511,"density_atomic":0.052427817657625254,"volume":1373.3167470404542,"volume_molar":11.486537164920735,"formula_full":"Al8 Si16 O48","formula_reduced":"Al(SiO3)2","formula_anonymous":"AB2C6","energy":-570.72047122,"energy_per_atom":-7.92667321138889,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-537.74447122,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":7.9473426,"is_theoretical":false,"updated_at":"2021-11-28T01:35:02.709000Z","spacegroup":142},{"id":"mp-621581","created_at":"2022-09-04T14:40:17.719075Z","structure_string":"P12 Rh16\n1.0\n3.346168 0.000000 0.000000\n0.000000 10.120048 0.000000\n0.000000 0.000000 11.795803\nP Rh\n12 16\ndirect\n0.750000 0.920852 0.630736 P\n0.750000 0.079818 0.872413 P\n0.750000 0.239706 0.624033 P\n0.250000 0.079148 0.369264 P\n0.250000 0.739706 0.875967 P\n0.250000 0.579818 0.627587 P\n0.250000 0.920182 0.127587 P\n0.750000 0.579148 0.130736 P\n0.250000 0.420852 0.869264 P\n0.750000 0.260294 0.124033 P\n0.750000 0.420182 0.372413 P\n0.250000 0.760294 0.375967 P\n0.250000 0.929906 0.771159 Rh\n0.250000 0.406224 0.064544 Rh\n0.750000 0.881997 0.973166 Rh\n0.750000 0.593776 0.935456 Rh\n0.250000 0.291216 0.295065 Rh\n0.250000 0.381997 0.526834 Rh\n0.750000 0.070094 0.228841 Rh\n0.250000 0.093776 0.564544 Rh\n0.250000 0.570094 0.271159 Rh\n0.750000 0.618003 0.473166 Rh\n0.750000 0.906224 0.435456 Rh\n0.750000 0.429906 0.728841 Rh\n0.250000 0.118003 0.026834 Rh\n0.750000 0.791216 0.204935 Rh\n0.750000 0.708784 0.704935 Rh\n0.250000 0.208784 0.795065 Rh\n","nsites":28,"nelements":2,"elements":["P","Rh"],"chemical_system":"P-Rh","density":8.389763048318693,"density_atomic":0.07009712507845638,"volume":399.4457685484381,"volume_molar":8.591138014946697,"formula_full":"P12 Rh16","formula_reduced":"P3Rh4","formula_anonymous":"A3B4","energy":-202.37989524,"energy_per_atom":-7.227853401428571,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-202.37989524,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.000199,"is_theoretical":false,"updated_at":"2021-11-28T01:34:58.693000Z","spacegroup":62}]}