{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=formula_reduced&page=83","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=formula_reduced&page=81","results":[{"id":"mp-560923","created_at":"2022-09-04T14:48:16.876423Z","structure_string":"Ag2 Pb8 Cl2 O8\n1.0\n8.456078 0.000000 0.000000\n0.000000 8.456078 0.000000\n0.000000 0.000000 6.551467\nAg Pb Cl O\n2 8 2 8\ndirect\n0.500000 0.000000 0.904112 Ag\n0.000000 0.500000 0.095888 Ag\n0.195600 0.143901 0.223866 Pb\n0.356099 0.695600 0.223866 Pb\n0.643901 0.304400 0.223866 Pb\n0.304400 0.356099 0.776134 Pb\n0.143901 0.804400 0.776134 Pb\n0.856099 0.195600 0.776134 Pb\n0.804400 0.856099 0.223866 Pb\n0.695600 0.643901 0.776134 Pb\n0.000000 0.500000 0.486916 Cl\n0.500000 0.000000 0.513084 Cl\n0.752839 0.089672 0.071319 O\n0.410328 0.252839 0.071319 O\n0.247161 0.910328 0.071319 O\n0.589672 0.747161 0.071319 O\n0.910328 0.752839 0.928681 O\n0.252839 0.589672 0.928681 O\n0.089672 0.247161 0.928681 O\n0.747161 0.410328 0.928681 O\n","nsites":20,"nelements":4,"elements":["Ag","Pb","Cl","O"],"chemical_system":"Ag-Cl-O-Pb","density":7.345343813075236,"density_atomic":0.042692685808056734,"volume":468.46431938994357,"volume_molar":14.105790362019187,"formula_full":"Ag2 Pb8 Cl2 O8","formula_reduced":"AgPb4ClO4","formula_anonymous":"ABC4D4","energy":-105.44414723,"energy_per_atom":-5.2722073615,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-98.72014723,"band_gap":2.4109,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0006429,"is_theoretical":false,"updated_at":"2021-11-28T01:38:54.809000Z","spacegroup":85},{"id":"mp-559470","created_at":"2022-09-04T14:39:59.715068Z","structure_string":"Ag2 Pb2 Br2 O2\n1.0\n4.027180 0.000000 0.000000\n0.000000 4.027180 0.000000\n0.000000 0.000000 14.241874\nAg Pb Br O\n2 2 2 2\ndirect\n0.500000 0.000000 0.407818 Ag\n0.000000 0.500000 0.592182 Ag\n0.000000 0.500000 0.084665 Pb\n0.500000 0.000000 0.915335 Pb\n0.000000 0.500000 0.385807 Br\n0.500000 0.000000 0.614193 Br\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n","nsites":8,"nelements":4,"elements":["Ag","Pb","Br","O"],"chemical_system":"Ag-Br-O-Pb","density":5.909104663224649,"density_atomic":0.03463544445388324,"volume":230.97725830115803,"volume_molar":17.387219523105653,"formula_full":"Ag2 Pb2 Br2 O2","formula_reduced":"AgPbBrO","formula_anonymous":"ABCD","energy":-34.33912115,"energy_per_atom":-4.29239014375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-31.89712115,"band_gap":0.1882999999999999,"is_gap_direct":true,"is_magnetic":false,"total_magnetization":0.0001555,"is_theoretical":false,"updated_at":"2021-11-28T01:34:44.800000Z","spacegroup":129},{"id":"mp-1206101","created_at":"2022-09-04T14:45:10.743378Z","structure_string":"Ag1 Pb1 F6\n1.0\n-2.587713 -4.372650 -2.396447\n-5.570236 -0.014205 -0.072887\n0.015955 -0.200885 -5.920679\nAg Pb F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Ag\n0.000000 0.500000 0.500000 Pb\n0.888821 0.863384 0.744415 F\n0.111179 0.136616 0.255585 F\n0.869649 0.753655 0.252249 F\n0.130351 0.246345 0.747751 F\n0.540813 0.605341 0.726272 F\n0.459187 0.394659 0.273728 F\n","nsites":8,"nelements":3,"elements":["Ag","Pb","F"],"chemical_system":"Ag-F-Pb","density":5.040407641408272,"density_atomic":0.05659654500623058,"volume":141.35138459634416,"volume_molar":10.640474183251005,"formula_full":"Ag1 Pb1 F6","formula_reduced":"AgPbF6","formula_anonymous":"ABC6","energy":-33.46951273,"energy_per_atom":-4.18368909125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-30.69751273,"band_gap":0.2179999999999999,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.0013274,"is_theoretical":true,"updated_at":"2021-11-28T01:36:51.688000Z","spacegroup":2},{"id":"mp-997019","created_at":"2022-09-04T14:48:13.445726Z","structure_string":"Ag2 Pb2 O4\n1.0\n1.780265 6.519733 0.000000\n-1.780265 6.519733 0.000000\n0.000000 0.950972 6.430624\nAg Pb O\n2 2 4\ndirect\n0.749680 0.749680 0.195327 Ag\n0.250320 0.250320 0.804673 Ag\n0.500000 0.500000 0.000000 Pb\n0.000000 0.000000 0.500000 Pb\n0.912360 0.912360 0.170379 O\n0.412396 0.412396 0.737937 O\n0.587604 0.587604 0.262063 O\n0.087640 0.087640 0.829621 O\n","nsites":8,"nelements":3,"elements":["Ag","Pb","O"],"chemical_system":"Ag-O-Pb","density":7.721378428408064,"density_atomic":0.053591067745616935,"volume":149.2786081063723,"volume_molar":11.23720988091814,"formula_full":"Ag2 Pb2 O4","formula_reduced":"AgPbO2","formula_anonymous":"ABC2","energy":-40.8608677,"energy_per_atom":-5.1076084625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-38.1128677,"band_gap":0.0334000000000003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0008197,"is_theoretical":true,"updated_at":"2021-11-28T01:38:47.205000Z","spacegroup":12},{"id":"mp-997021","created_at":"2022-09-04T14:45:18.065458Z","structure_string":"Ag2 Pb2 O4\n1.0\n3.571676 0.000000 0.000000\n0.000000 6.478030 0.000000\n0.000000 2.404691 6.408123\nAg Pb O\n2 2 4\ndirect\n0.500000 0.000000 0.500000 Ag\n0.000000 0.500000 0.500000 Ag\n0.500000 0.500000 0.000000 Pb\n0.000000 0.000000 0.000000 Pb\n0.000000 0.580837 0.175454 O\n0.000000 0.419163 0.824546 O\n0.500000 0.144738 0.175198 O\n0.500000 0.855262 0.824802 O\n","nsites":8,"nelements":3,"elements":["Ag","Pb","O"],"chemical_system":"Ag-O-Pb","density":7.7740363204534795,"density_atomic":0.05395654557915566,"volume":148.26746067840446,"volume_molar":11.161093979163958,"formula_full":"Ag2 Pb2 O4","formula_reduced":"AgPbO2","formula_anonymous":"ABC2","energy":-40.77170257,"energy_per_atom":-5.09646282125,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-38.02370257,"band_gap":0.1427999999999998,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.000943,"is_theoretical":true,"updated_at":"2021-11-28T01:37:05.833000Z","spacegroup":10},{"id":"mp-1178556","created_at":"2022-09-04T14:41:16.152547Z","structure_string":"Ag2 Pb2 O6\n1.0\n5.330899 -2.889288 0.000000\n5.330899 2.889288 0.000000\n3.764938 0.000000 4.753074\nAg Pb O\n2 2 6\ndirect\n0.857425 0.857425 0.857425 Ag\n0.142575 0.142575 0.142575 Ag\n0.354165 0.354165 0.354165 Pb\n0.645835 0.645835 0.645835 Pb\n0.543821 0.951901 0.261131 O\n0.738869 0.456179 0.048099 O\n0.048099 0.738869 0.456179 O\n0.951901 0.261131 0.543821 O\n0.261131 0.543821 0.951901 O\n0.456179 0.048099 0.738869 O\n","nsites":10,"nelements":3,"elements":["Ag","Pb","O"],"chemical_system":"Ag-O-Pb","density":8.23510787178762,"density_atomic":0.0682973951800929,"volume":146.41846842959492,"volume_molar":8.817526267466368,"formula_full":"Ag2 Pb2 O6","formula_reduced":"AgPbO3","formula_anonymous":"ABC3","energy":-51.25327082,"energy_per_atom":-5.125327082,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-47.13127082,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0014088,"is_theoretical":true,"updated_at":"2021-11-28T01:35:08.044000Z","spacegroup":148},{"id":"mp-1229012","created_at":"2022-09-04T14:43:58.753980Z","structure_string":"Ag1 Pd1\n1.0\n4.733684 -1.435646 0.000000\n4.733684 1.435646 0.000000\n4.298277 0.000000 2.448196\nAg Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Pd\n","nsites":2,"nelements":2,"elements":["Ag","Pd"],"chemical_system":"Ag-Pd","density":10.69361505301019,"density_atomic":0.06010452755190154,"volume":33.27536346197809,"volume_molar":10.019446130409648,"formula_full":"Ag1 Pd1","formula_reduced":"AgPd","formula_anonymous":"AB","energy":-8.13020257,"energy_per_atom":-4.065101285,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-8.13020257,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":6.17e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:36:07.928000Z","spacegroup":166},{"id":"mp-1183222","created_at":"2022-09-04T14:41:53.473145Z","structure_string":"Ag1 Pd1\n1.0\n1.429520 -2.476001 0.000000\n1.429520 2.476001 0.000000\n0.000000 0.000000 4.700114\nAg Pd\n1 1\ndirect\n0.000000 0.000000 0.500000 Ag\n0.666667 0.333333 0.000000 Pd\n","nsites":2,"nelements":2,"elements":["Ag","Pd"],"chemical_system":"Ag-Pd","density":10.694682977225131,"density_atomic":0.06011052992622324,"volume":33.272040729880494,"volume_molar":10.018445632389673,"formula_full":"Ag1 Pd1","formula_reduced":"AgPd","formula_anonymous":"AB","energy":-8.10259649,"energy_per_atom":-4.051298245,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-8.10259649,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0006883,"is_theoretical":true,"updated_at":"2021-11-28T01:35:33.877000Z","spacegroup":187},{"id":"mp-1229031","created_at":"2022-09-04T14:42:17.525203Z","structure_string":"Ag1 Pd2 Au1\n1.0\n9.360150 -1.437397 0.000000\n9.360150 1.437397 0.000000\n9.139415 0.000000 2.479840\nAg Pd Au\n1 2 1\ndirect\n0.998031 0.998031 0.998031 Ag\n0.501829 0.501829 0.501829 Pd\n0.248508 0.248508 0.248508 Pd\n0.751632 0.751632 0.751632 Au\n","nsites":4,"nelements":3,"elements":["Ag","Pd","Au"],"chemical_system":"Ag-Au-Pd","density":12.88228481085152,"density_atomic":0.059944148035669435,"volume":66.72878222607855,"volume_molar":10.046252982720778,"formula_full":"Ag1 Pd2 Au1","formula_reduced":"AgPd2Au","formula_anonymous":"ABC2","energy":-16.68869921,"energy_per_atom":-4.1721748025,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-16.68869921,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.37e-05,"is_theoretical":true,"updated_at":"2021-11-28T01:35:41.108000Z","spacegroup":160},{"id":"mp-1093988","created_at":"2022-09-04T14:45:28.369358Z","structure_string":"Ag1 Pd2 Au1\n1.0\n-5.269057 5.384305 7.536851\n5.269057 -5.384305 7.536851\n5.269057 5.384305 -7.536851\nAg Pd Au\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.000000 0.253308 0.253308 Pd\n0.000000 0.746692 0.746692 Pd\n0.000000 0.500000 0.500000 Au\n","nsites":4,"nelements":3,"elements":["Ag","Pd","Au"],"chemical_system":"Ag-Au-Pd","density":1.0050637865401093,"density_atomic":0.004676786244851576,"volume":855.2881809390767,"volume_molar":128.76664539948675,"formula_full":"Ag1 Pd2 Au1","formula_reduced":"AgPd2Au","formula_anonymous":"ABC2","energy":-8.30794131,"energy_per_atom":-2.0769853275,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-8.30794131,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0062372,"is_theoretical":true,"updated_at":"2021-11-28T01:36:54.118000Z","spacegroup":71},{"id":"mp-1097539","created_at":"2022-09-04T14:44:58.166422Z","structure_string":"Ag1 Pd2 Pb1\n1.0\n-5.167659 5.889676 8.324546\n5.167659 -5.889676 8.324546\n5.167659 5.889676 -8.324546\nAg Pd Pb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.000000 0.258159 0.258159 Pd\n0.000000 0.741841 0.741841 Pd\n0.000000 0.500000 0.500000 Pb\n","nsites":4,"nelements":3,"elements":["Ag","Pd","Pb"],"chemical_system":"Ag-Pb-Pd","density":0.8649713132822026,"density_atomic":0.003946882434292623,"volume":1013.4581068961828,"volume_molar":152.5796843522985,"formula_full":"Ag1 Pd2 Pb1","formula_reduced":"AgPd2Pb","formula_anonymous":"ABC2","energy":-10.69141761,"energy_per_atom":-2.6728544025,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-10.69141761,"band_gap":0.6372,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0004745,"is_theoretical":true,"updated_at":"2021-11-28T01:36:41.973000Z","spacegroup":71},{"id":"mp-1200271","created_at":"2022-09-04T14:46:12.880731Z","structure_string":"Ag8 Pd24 Se8\n1.0\n8.775577 0.000000 0.000000\n0.000000 8.775577 0.000000\n0.000000 0.000000 8.775577\nAg Pd Se\n8 24 8\ndirect\n0.093665 0.906335 0.406335 Ag\n0.906335 0.406335 0.093665 Ag\n0.406335 0.093665 0.906335 Ag\n0.593665 0.593665 0.593665 Ag\n0.906335 0.093665 0.593665 Ag\n0.093665 0.593665 0.906335 Ag\n0.593665 0.906335 0.093665 Ag\n0.406335 0.406335 0.406335 Ag\n0.862454 0.086651 0.222514 Pd\n0.137546 0.586651 0.277486 Pd\n0.637546 0.913349 0.722514 Pd\n0.362454 0.413349 0.777486 Pd\n0.222514 0.862454 0.086651 Pd\n0.277486 0.137546 0.586651 Pd\n0.722514 0.637546 0.913349 Pd\n0.777486 0.362454 0.413349 Pd\n0.086651 0.222514 0.862454 Pd\n0.586651 0.277486 0.137546 Pd\n0.913349 0.722514 0.637546 Pd\n0.413349 0.777486 0.362454 Pd\n0.137546 0.913349 0.777486 Pd\n0.862454 0.413349 0.722514 Pd\n0.362454 0.086651 0.277486 Pd\n0.637546 0.586651 0.222514 Pd\n0.777486 0.137546 0.913349 Pd\n0.722514 0.862454 0.413349 Pd\n0.277486 0.362454 0.086651 Pd\n0.222514 0.637546 0.586651 Pd\n0.913349 0.777486 0.137546 Pd\n0.413349 0.722514 0.862454 Pd\n0.086651 0.277486 0.362454 Pd\n0.586651 0.222514 0.637546 Pd\n0.376825 0.623175 0.123175 Se\n0.623175 0.123175 0.376825 Se\n0.123175 0.376825 0.623175 Se\n0.876825 0.876825 0.876825 Se\n0.623175 0.376825 0.876825 Se\n0.376825 0.876825 0.623175 Se\n0.876825 0.623175 0.376825 Se\n0.123175 0.123175 0.123175 Se\n","nsites":40,"nelements":3,"elements":["Ag","Pd","Se"],"chemical_system":"Ag-Pd-Se","density":9.94805670551939,"density_atomic":0.059187902217244716,"volume":675.813781221423,"volume_molar":10.174614295158134,"formula_full":"Ag8 Pd24 Se8","formula_reduced":"AgPd3Se","formula_anonymous":"ABC3","energy":-185.48868004,"energy_per_atom":-4.637217001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-181.71268004,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.2051388,"is_theoretical":false,"updated_at":"2021-11-28T01:37:28.384000Z","spacegroup":205}]}