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0.815896 0.500000 Pd\n","nsites":12,"nelements":2,"elements":["As","Pd"],"chemical_system":"As-Pd","density":10.778529454713091,"density_atomic":0.06415899030728368,"volume":187.03536234792793,"volume_molar":9.386277326306885,"formula_full":"As2 Pd10","formula_reduced":"AsPd5","formula_anonymous":"AB5","energy":-64.35730086,"energy_per_atom":-5.363108404999999,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-64.35730086,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0029893,"is_theoretical":false,"updated_at":"2021-11-28T01:35:45.042000Z","spacegroup":12},{"id":"mp-1036528","created_at":"2022-09-04T14:42:20.363658Z","structure_string":"Li1 Mg14 Al1 O16\n1.0\n8.478753 0.000000 0.000000\n0.000000 8.478753 0.000000\n0.000000 0.000000 4.229030\nLi Mg Al O\n1 14 1 16\ndirect\n0.500000 0.500000 0.000000 Li\n0.500000 0.000000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n0.251951 0.000000 0.500000 Mg\n0.748049 0.000000 0.500000 Mg\n0.257475 0.500000 0.500000 Mg\n0.742525 0.500000 0.500000 Mg\n0.000000 0.251951 0.500000 Mg\n0.500000 0.257475 0.500000 Mg\n0.000000 0.748049 0.500000 Mg\n0.500000 0.742525 0.500000 Mg\n0.255681 0.255681 0.000000 Mg\n0.744319 0.255681 0.000000 Mg\n0.255681 0.744319 0.000000 Mg\n0.744319 0.744319 0.000000 Mg\n0.000000 0.000000 0.000000 Al\n0.000000 0.229228 0.000000 O\n0.500000 0.238720 0.000000 O\n0.000000 0.770772 0.000000 O\n0.500000 0.761280 0.000000 O\n0.248639 0.248639 0.500000 O\n0.751361 0.248639 0.500000 O\n0.248639 0.751361 0.500000 O\n0.751361 0.751361 0.500000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.500000 O\n0.229228 0.000000 0.000000 O\n0.770772 0.000000 0.000000 O\n0.238720 0.500000 0.000000 O\n0.761280 0.500000 0.000000 O\n","nsites":32,"nelements":4,"elements":["Li","Mg","Al","O"],"chemical_system":"Al-Li-Mg-O","density":3.4420011021079904,"density_atomic":0.10525560815051965,"volume":304.02180522522605,"volume_molar":5.7214440786737955,"formula_full":"Li1 Mg14 Al1 O16","formula_reduced":"LiMg14AlO16","formula_anonymous":"ABC14D16","energy":-204.09470333,"energy_per_atom":-6.3779594790625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-193.10270333,"band_gap":4.081900000000001,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0,"is_theoretical":true,"updated_at":"2021-11-28T01:35:43.910000Z","spacegroup":123},{"id":"mp-1097428","created_at":"2022-09-04T14:42:20.363781Z","structure_string":"Cd1 Sn1 Pd2\n1.0\n-5.165422 5.551826 7.853346\n5.165422 -5.551826 7.853346\n5.165422 5.551826 -7.853346\nCd Sn Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Cd\n0.000000 0.500000 0.500000 Sn\n0.000000 0.262197 0.262197 Pd\n0.000000 0.737803 0.737803 Pd\n","nsites":4,"nelements":3,"elements":["Cd","Sn","Pd"],"chemical_system":"Cd-Pd-Sn","density":0.8183470871147239,"density_atomic":0.004440211055334978,"volume":900.858078625326,"volume_molar":135.62735385662154,"formula_full":"Cd1 Sn1 Pd2","formula_reduced":"CdSnPd2","formula_anonymous":"ABC2","energy":-10.62995181,"energy_per_atom":-2.6574879525,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-10.62995181,"band_gap":0.7024000000000004,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":6.59e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:35:46.435000Z","spacegroup":71}]}