{"count":1013513,"next":"https://simmate.org/third-parties/OqmdStructure/?format=json&ordering=-created_at&page=29","previous":"https://simmate.org/third-parties/OqmdStructure/?format=json&ordering=-created_at&page=27","results":[{"id":"oqmd-1759270","created_at":"2022-09-04T16:03:16.991557Z","updated_at":"2022-09-04T16:03:16.991584Z","structure_string":"Yb2 Eu4 Ta2 O12\n1.0\n5.643773 0.000000 0.000000\n0.000000 5.852248 0.000000\n-5.601380 0.000000 8.053124\nEu O Ta Yb\n4 12 2 2\ndirect\n0.727707 0.441301 0.246692 Eu\n0.272293 0.941301 0.253308 Eu\n0.727707 0.058699 0.746692 Eu\n0.272293 0.558699 0.753308 Eu\n0.336127 0.686692 0.052572 O\n0.244358 0.220080 0.062726 O\n0.122381 0.542660 0.233074 O\n0.877619 0.042660 0.266926 O\n0.755642 0.720080 0.437274 O\n0.663873 0.186692 0.447428 O\n0.336127 0.813308 0.552572 O\n0.244358 0.279920 0.562726 O\n0.122381 0.957340 0.733074 O\n0.877619 0.457340 0.766926 O\n0.755642 0.779920 0.937274 O\n0.663873 0.313308 0.947428 O\n0.000000 0.500000 0.000000 Ta\n0.000000 0.000000 0.500000 Ta\n0.500000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Yb\n","nsites":20,"nelements":4,"elements":["Eu","O","Ta","Yb"],"chemical_system":"Eu-O-Ta-Yb","density":9.413329584867878,"density_atomic":0.07519229664217304,"volume":265.98469382011956,"volume_molar":8.008986330951311,"formula_full":"Yb2 Eu4 Ta2 O12","formula_reduced":"YbEu2TaO6","formula_anonymous":"ABC2D6","formation_energy":-3.328627060027253,"spacegroup":14},{"id":"oqmd-1757171","created_at":"2022-09-04T16:03:16.984318Z","updated_at":"2022-09-04T16:03:16.984330Z","structure_string":"Cr2 Sb2 O8\n1.0\n-2.469648 2.469648 5.193246\n2.469648 -2.469648 5.193246\n2.469648 2.469648 -5.193246\nCr O Sb\n2 8 2\ndirect\n0.500000 0.500000 0.000000 Cr\n0.250000 0.750000 0.500000 Cr\n0.932962 0.398282 0.008921 O\n0.674041 0.182962 0.034680 O\n0.075959 0.067038 0.465320 O\n0.817038 0.851718 0.491079 O\n0.360639 0.325959 0.508921 O\n0.601718 0.610639 0.534680 O\n0.148282 0.639361 0.965320 O\n0.389361 0.924041 0.991079 O\n0.000000 0.000000 0.000000 Sb\n0.750000 0.250000 0.500000 Sb\n","nsites":12,"nelements":3,"elements":["Cr","O","Sb"],"chemical_system":"Cr-O-Sb","density":6.232142511154122,"density_atomic":0.09471357825729701,"volume":126.69777893303788,"volume_molar":6.358265489284306,"formula_full":"Cr2 Sb2 O8","formula_reduced":"CrSbO4","formula_anonymous":"ABC4","formation_energy":-1.6825604879623797,"spacegroup":88},{"id":"oqmd-1722284","created_at":"2022-09-04T16:03:16.983832Z","updated_at":"2022-09-04T16:03:16.983865Z","structure_string":"Nd2 Re1 Rh1 O6\n1.0\n0.000000 3.993457 3.993457\n3.993457 0.000000 3.993457\n3.993457 3.993457 0.000000\nNd O Re Rh\n2 6 1 1\ndirect\n0.250000 0.250000 0.250000 Nd\n0.750000 0.750000 0.750000 Nd\n0.752584 0.247416 0.247416 O\n0.247416 0.752584 0.247416 O\n0.752584 0.752584 0.247416 O\n0.247416 0.247416 0.752584 O\n0.752584 0.247416 0.752584 O\n0.247416 0.752584 0.752584 O\n0.000000 0.000000 0.000000 Re\n0.500000 0.500000 0.500000 Rh\n","nsites":10,"nelements":4,"elements":["Nd","O","Re","Rh"],"chemical_system":"Nd-O-Re-Rh","density":8.781517380013415,"density_atomic":0.07850963655807924,"volume":127.3728989001532,"volume_molar":7.670575261859718,"formula_full":"Nd2 Re1 Rh1 O6","formula_reduced":"Nd2ReRhO6","formula_anonymous":"ABC2D6","formation_energy":-2.014285194027252,"spacegroup":225},{"id":"oqmd-1759268","created_at":"2022-09-04T16:03:16.978612Z","updated_at":"2022-09-04T16:03:16.978634Z","structure_string":"Tb2 Eu4 Ta2 O12\n1.0\n5.668166 0.000000 0.000000\n0.000000 5.834925 0.000000\n-5.637275 0.000000 8.101135\nEu O Ta Tb\n4 12 2 2\ndirect\n0.263370 0.550111 0.248843 Eu\n0.736630 0.050111 0.251157 Eu\n0.263370 0.949889 0.748843 Eu\n0.736630 0.449889 0.751157 Eu\n0.269509 0.311444 0.052731 O\n0.375092 0.782390 0.058895 O\n0.838446 0.462973 0.233672 O\n0.161554 0.962973 0.266328 O\n0.624908 0.282390 0.441105 O\n0.730491 0.811444 0.447269 O\n0.269509 0.188556 0.552731 O\n0.375092 0.717610 0.558895 O\n0.838446 0.037027 0.733672 O\n0.161554 0.537027 0.766328 O\n0.624908 0.217610 0.941105 O\n0.730491 0.688556 0.947269 O\n0.500000 0.500000 0.000000 Ta\n0.500000 0.000000 0.500000 Ta\n0.000000 0.000000 0.000000 Tb\n0.000000 0.500000 0.500000 Tb\n","nsites":20,"nelements":4,"elements":["Eu","O","Ta","Tb"],"chemical_system":"Eu-O-Ta-Tb","density":9.169978565642632,"density_atomic":0.07464595649970746,"volume":267.93145855232467,"volume_molar":8.067604787171025,"formula_full":"Tb2 Eu4 Ta2 O12","formula_reduced":"TbEu2TaO6","formula_anonymous":"ABC2D6","formation_energy":-3.55026329549392,"spacegroup":14},{"id":"oqmd-1725781","created_at":"2022-09-04T16:03:16.978063Z","updated_at":"2022-09-04T16:03:16.978089Z","structure_string":"K2 V2 Cl6\n1.0\n-3.412935 3.412935 5.052469\n3.412935 -3.412935 5.052469\n3.412935 3.412935 -5.052469\nCl K V\n6 2 2\ndirect\n0.250000 0.250000 0.000000 Cl\n0.750000 0.750000 0.000000 Cl\n0.307623 0.807623 0.115245 Cl\n0.192377 0.307623 0.500000 Cl\n0.807623 0.692377 0.500000 Cl\n0.692377 0.192377 0.884755 Cl\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500000 K\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.000000 V\n","nsites":10,"nelements":3,"elements":["Cl","K","V"],"chemical_system":"Cl-K-V","density":2.770755729159773,"density_atomic":0.042479590044192925,"volume":235.4071682329483,"volume_molar":14.176551030118151,"formula_full":"K2 V2 Cl6","formula_reduced":"KVCl3","formula_anonymous":"ABC3","formation_energy":-1.6447801363714736,"spacegroup":140},{"id":"oqmd-1730697","created_at":"2022-09-04T16:03:16.976316Z","updated_at":"2022-09-04T16:03:16.976344Z","structure_string":"Yb1 Eu2 Nb1 O6\n1.0\n-2.801482 2.801482 4.226729\n2.801482 -2.801482 4.226729\n2.801482 2.801482 -4.226729\nEu Nb O Yb\n2 1 6 1\ndirect\n0.750000 0.250000 0.500000 Eu\n0.250000 0.750000 0.500000 Eu\n0.500000 0.500000 0.000000 Nb\n0.263070 0.263070 0.000000 O\n0.736930 0.736930 0.000000 O\n0.358495 0.826499 0.184993 O\n0.826499 0.641505 0.468004 O\n0.173501 0.358495 0.531996 O\n0.641505 0.173501 0.815007 O\n0.000000 0.000000 0.000000 Yb\n","nsites":10,"nelements":4,"elements":["Eu","Nb","O","Yb"],"chemical_system":"Eu-Nb-O-Yb","density":8.33295405301903,"density_atomic":0.0753633043805211,"volume":132.69057245033255,"volume_molar":7.990813048208808,"formula_full":"Yb1 Eu2 Nb1 O6","formula_reduced":"YbEu2NbO6","formula_anonymous":"ABC2D6","formation_energy":-3.1653267555272526,"spacegroup":87},{"id":"oqmd-1743456","created_at":"2022-09-04T16:03:16.975485Z","updated_at":"2022-09-04T16:03:16.975515Z","structure_string":"Fe2 Re2 O6\n1.0\n2.372465 1.369743 5.289631\n-2.372465 1.369743 5.289631\n0.000000 -2.739487 5.289631\nFe O Re\n2 6 2\ndirect\n0.156722 0.156722 0.156722 Fe\n0.843278 0.843278 0.843278 Fe\n0.750212 0.423099 0.074356 O\n0.576901 0.925644 0.249788 O\n0.074356 0.750212 0.423099 O\n0.925644 0.249788 0.576901 O\n0.423099 0.074356 0.750212 O\n0.249788 0.576901 0.925644 O\n0.337637 0.337637 0.337637 Re\n0.662363 0.662363 0.662363 Re\n","nsites":10,"nelements":3,"elements":["Fe","O","Re"],"chemical_system":"Fe-O-Re","density":9.339779546328232,"density_atomic":0.09695815950962074,"volume":103.13727127841926,"volume_molar":6.211071652409459,"formula_full":"Fe2 Re2 O6","formula_reduced":"FeReO3","formula_anonymous":"ABC3","formation_energy":-1.4610922802101,"spacegroup":148},{"id":"oqmd-1725860","created_at":"2022-09-04T16:03:16.974672Z","updated_at":"2022-09-04T16:03:16.974697Z","structure_string":"Ti2 Tl2 O6\n1.0\n-2.755125 2.755125 3.932574\n2.755125 -2.755125 3.932574\n2.755125 2.755125 -3.932574\nO Ti Tl\n6 2 2\ndirect\n0.250000 0.250000 0.000000 O\n0.750000 0.750000 0.000000 O\n0.293662 0.793662 0.087323 O\n0.206338 0.293662 0.500000 O\n0.793662 0.706338 0.500000 O\n0.706338 0.206338 0.912677 O\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.000000 Ti\n0.750000 0.250000 0.500000 Tl\n0.250000 0.750000 0.500000 Tl\n","nsites":10,"nelements":3,"elements":["O","Ti","Tl"],"chemical_system":"O-Ti-Tl","density":8.351037415699215,"density_atomic":0.08374916581889144,"volume":119.40417438455587,"volume_molar":7.190687454753818,"formula_full":"Ti2 Tl2 O6","formula_reduced":"TiTlO3","formula_anonymous":"ABC3","formation_energy":-2.149123319284506,"spacegroup":140},{"id":"oqmd-1732273","created_at":"2022-09-04T16:03:16.948610Z","updated_at":"2022-09-04T16:03:16.948632Z","structure_string":"Rb2 Nb2 Os2 Cl2 O10\n1.0\n6.798025 0.000000 0.000000\n0.000000 6.798025 0.000000\n0.000000 0.000000 7.685237\nCl Nb O Os Rb\n2 2 10 2 2\ndirect\n0.000000 0.500000 0.472485 Cl\n0.500000 0.000000 0.527515 Cl\n0.000000 0.500000 0.129106 Nb\n0.500000 0.000000 0.870894 Nb\n0.500000 0.000000 0.099944 O\n0.000000 0.199814 0.161006 O\n0.300186 0.500000 0.161006 O\n0.699814 0.500000 0.161006 O\n0.000000 0.800186 0.161006 O\n0.199814 0.000000 0.838994 O\n0.800186 0.000000 0.838994 O\n0.500000 0.300186 0.838994 O\n0.500000 0.699814 0.838994 O\n0.000000 0.500000 0.900056 O\n0.000000 0.000000 0.000000 Os\n0.500000 0.500000 0.000000 Os\n0.000000 0.000000 0.500000 Rb\n0.500000 0.500000 0.500000 Rb\n","nsites":18,"nelements":5,"elements":["Cl","Nb","O","Os","Rb"],"chemical_system":"Cl-Nb-O-Os-Rb","density":4.526372464688158,"density_atomic":0.05068153096325734,"volume":355.15896339140755,"volume_molar":11.88231816510413,"formula_full":"Rb2 Nb2 Os2 Cl2 O10","formula_reduced":"RbNbOsClO5","formula_anonymous":"ABCDE5","formation_energy":-1.8259124144458776,"spacegroup":129},{"id":"oqmd-1752748","created_at":"2022-09-04T16:03:16.948152Z","updated_at":"2022-09-04T16:03:16.948164Z","structure_string":"Li2 Y2 Cl8\n1.0\n-3.204049 3.204049 6.533288\n3.204049 -3.204049 6.533288\n3.204049 3.204049 -6.533288\nCl Li Y\n8 2 2\ndirect\n0.495296 0.888114 0.045801 Cl\n0.199494 0.745296 0.107181 Cl\n0.550506 0.504704 0.392819 Cl\n0.254704 0.361886 0.454199 Cl\n0.907687 0.800506 0.545801 Cl\n0.111886 0.157687 0.607181 Cl\n0.638114 0.092313 0.892819 Cl\n0.842313 0.449494 0.954199 Cl\n0.000000 0.000000 0.000000 Li\n0.750000 0.250000 0.500000 Li\n0.500000 0.500000 0.000000 Y\n0.250000 0.750000 0.500000 Y\n","nsites":12,"nelements":3,"elements":["Cl","Li","Y"],"chemical_system":"Cl-Li-Y","density":2.942002189201141,"density_atomic":0.04472920231429233,"volume":268.28110896504046,"volume_molar":13.463555011969762,"formula_full":"Li2 Y2 Cl8","formula_reduced":"LiYCl4","formula_anonymous":"ABC4","formation_energy":-2.335639538746081,"spacegroup":88},{"id":"oqmd-1757173","created_at":"2022-09-04T16:03:16.944437Z","updated_at":"2022-09-04T16:03:16.944455Z","structure_string":"Sb2 Br2 O8\n1.0\n-2.625357 2.625357 5.088472\n2.625357 -2.625357 5.088472\n2.625357 2.625357 -5.088472\nBr O Sb\n2 8 2\ndirect\n0.000000 0.000000 0.000000 Br\n0.750000 0.250000 0.500000 Br\n0.872020 0.517884 0.002909 O\n0.267884 0.764975 0.145864 O\n0.482116 0.485025 0.354136 O\n0.877980 0.732116 0.497091 O\n0.235025 0.380889 0.502909 O\n0.130889 0.127980 0.645864 O\n0.619111 0.122020 0.854136 O\n0.514975 0.869111 0.997091 O\n0.500000 0.500000 0.000000 Sb\n0.250000 0.750000 0.500000 Sb\n","nsites":12,"nelements":3,"elements":["Br","O","Sb"],"chemical_system":"Br-O-Sb","density":6.28903137115062,"density_atomic":0.0855376136578559,"volume":140.2891603686667,"volume_molar":7.04034225701937,"formula_full":"Sb2 Br2 O8","formula_reduced":"SbBrO4","formula_anonymous":"ABC4","formation_energy":-0.6267688559884755,"spacegroup":88},{"id":"oqmd-1725536","created_at":"2022-09-04T16:03:16.940814Z","updated_at":"2022-09-04T16:03:16.940840Z","structure_string":"Sm2 Ta1 Mn1 O6\n1.0\n-2.772966 2.772966 4.073716\n2.772966 -2.772966 4.073716\n2.772966 2.772966 -4.073716\nMn O Sm Ta\n1 6 2 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.254720 0.254720 0.000000 O\n0.745280 0.745280 0.000000 O\n0.338742 0.821258 0.160000 O\n0.821258 0.661258 0.482516 O\n0.178742 0.338742 0.517484 O\n0.661258 0.178742 0.840000 O\n0.750000 0.250000 0.500000 Sm\n0.250000 0.750000 0.500000 Sm\n0.500000 0.500000 0.000000 Ta\n","nsites":10,"nelements":4,"elements":["Mn","O","Sm","Ta"],"chemical_system":"Mn-O-Sm-Ta","density":8.383783444807484,"density_atomic":0.07981052555163473,"volume":125.29675667315755,"volume_molar":7.54554705457224,"formula_full":"Sm2 Ta1 Mn1 O6","formula_reduced":"Sm2TaMnO6","formula_anonymous":"ABC2D6","formation_energy":-3.0056346272484395,"spacegroup":87}]}