{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-energy&page=87","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-energy&page=85","results":[{"id":"mp-1185577","created_at":"2022-09-04T14:44:14.008628Z","structure_string":"Cs2 Hg6\n1.0\n3.922969 -6.794781 0.000000\n3.922969 6.794781 0.000000\n0.000000 0.000000 5.920655\nCs Hg\n2 6\ndirect\n0.333333 0.666667 0.750000 Cs\n0.666667 0.333333 0.250000 Cs\n0.140578 0.281156 0.250000 Hg\n0.718844 0.859422 0.250000 Hg\n0.140578 0.859422 0.250000 Hg\n0.859422 0.718844 0.750000 Hg\n0.281156 0.140578 0.750000 Hg\n0.859422 0.140578 0.750000 Hg\n","nsites":8,"nelements":2,"elements":["Cs","Hg"],"chemical_system":"Cs-Hg","density":7.730089655937429,"density_atomic":0.0253454435648675,"volume":315.63858724844624,"volume_molar":23.760250021221058,"formula_full":"Cs2 Hg6","formula_reduced":"CsHg3","formula_anonymous":"AB3","energy":-5.4190519,"energy_per_atom":-0.6773814875,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.4190519,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0004225,"is_theoretical":true,"updated_at":"2021-11-28T01:36:35.600000Z","spacegroup":194},{"id":"mp-1094232","created_at":"2022-09-04T14:45:53.832671Z","structure_string":"Mg1 Sn1\n1.0\n0.000000 2.996797 2.996797\n2.996797 0.000000 2.996797\n2.996797 2.996797 0.000000\nMg Sn\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Sn\n","nsites":2,"nelements":2,"elements":["Mg","Sn"],"chemical_system":"Mg-Sn","density":4.411931047871228,"density_atomic":0.03715592043194994,"volume":53.82722260004151,"volume_molar":16.207755560865156,"formula_full":"Mg1 Sn1","formula_reduced":"MgSn","formula_anonymous":"AB","energy":-5.4199715,"energy_per_atom":-2.70998575,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.4199715,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001895,"is_theoretical":true,"updated_at":"2021-11-28T01:37:14.301000Z","spacegroup":225},{"id":"mp-1061855","created_at":"2022-09-04T14:48:01.433439Z","structure_string":"Dy1 Hg2\n1.0\n2.677834 -4.638144 0.000000\n2.677834 4.638144 0.000000\n0.000000 0.000000 3.447084\nDy Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Dy\n0.333333 0.666667 0.920512 Hg\n0.666667 0.333333 0.079488 Hg\n","nsites":3,"nelements":2,"elements":["Dy","Hg"],"chemical_system":"Dy-Hg","density":10.931304236124783,"density_atomic":0.035035757605242565,"volume":85.62680544265142,"volume_molar":17.188555840159363,"formula_full":"Dy1 Hg2","formula_reduced":"DyHg2","formula_anonymous":"AB2","energy":-5.42287397,"energy_per_atom":-1.8076246566666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.42287397,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0198751,"is_theoretical":false,"updated_at":"2021-11-28T01:38:24.526000Z","spacegroup":164},{"id":"mp-1181998","created_at":"2022-09-04T14:41:53.670739Z","structure_string":"Br1 O1\n1.0\n3.357667 -1.884282 0.000000\n3.357667 1.884282 0.000000\n2.300231 0.000000 3.087618\nBr O\n1 1\ndirect\n0.957619 0.957619 0.957619 Br\n0.591181 0.591181 0.591181 O\n","nsites":2,"nelements":2,"elements":["Br","O"],"chemical_system":"Br-O","density":4.076111168747045,"density_atomic":0.05119091756931601,"volume":39.069430574122116,"volume_molar":11.76408051652055,"formula_full":"Br1 O1","formula_reduced":"BrO","formula_anonymous":"AB","energy":-5.431875310000001,"energy_per_atom":-2.7159376550000003,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.74487531,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":0.8279895,"is_theoretical":true,"updated_at":"2021-11-28T01:35:29.843000Z","spacegroup":160},{"id":"mp-12661","created_at":"2022-09-04T14:39:36.815549Z","structure_string":"Cd3 In1\n1.0\n4.595004 0.000000 0.000000\n0.000000 4.595004 0.000000\n0.000000 0.000000 4.595004\nCd In\n3 1\ndirect\n0.500000 0.500000 0.000000 Cd\n0.500000 0.000000 0.500000 Cd\n0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 In\n","nsites":4,"nelements":2,"elements":["Cd","In"],"chemical_system":"Cd-In","density":7.7371114087281025,"density_atomic":0.04122895336611525,"volume":97.01919824352058,"volume_molar":14.606581706120641,"formula_full":"Cd3 In1","formula_reduced":"Cd3In","formula_anonymous":"AB3","energy":-5.4322956,"energy_per_atom":-1.3580739,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.4322956,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0029659,"is_theoretical":false,"updated_at":"2021-11-28T01:34:26.985000Z","spacegroup":221},{"id":"mp-1064459","created_at":"2022-09-04T14:40:32.055677Z","structure_string":"P1 Br1\n1.0\n3.437410 0.000000 0.000000\n0.000000 3.437410 0.000000\n0.000000 0.000000 3.437410\nP Br\n1 1\ndirect\n0.000000 0.000000 0.000000 P\n0.500000 0.500000 0.500000 Br\n","nsites":2,"nelements":2,"elements":["P","Br"],"chemical_system":"Br-P","density":4.533144266693646,"density_atomic":0.049242034428599216,"volume":40.615706138218016,"volume_molar":12.229674971557246,"formula_full":"P1 Br1","formula_reduced":"PBr","formula_anonymous":"AB","energy":-5.43636809,"energy_per_atom":-2.718184045,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.90236809,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0017127,"is_theoretical":true,"updated_at":"2021-11-28T01:34:53.728000Z","spacegroup":221},{"id":"mp-1008754","created_at":"2022-09-04T14:48:27.644981Z","structure_string":"Tb1 Hg2\n1.0\n2.688185 -4.656072 0.000000\n2.688185 4.656072 0.000000\n0.000000 0.000000 3.396856\nTb Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.666667 0.333333 0.955840 Hg\n0.333333 0.666667 0.044160 Hg\n","nsites":3,"nelements":2,"elements":["Tb","Hg"],"chemical_system":"Hg-Tb","density":10.937872214927832,"density_atomic":0.035280544695360315,"volume":85.0327007676422,"volume_molar":17.069296440856714,"formula_full":"Tb1 Hg2","formula_reduced":"TbHg2","formula_anonymous":"AB2","energy":-5.43693113,"energy_per_atom":-1.8123103766666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.43693113,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0116414,"is_theoretical":false,"updated_at":"2021-11-28T01:39:17.549000Z","spacegroup":164},{"id":"mp-11307","created_at":"2022-09-04T14:39:37.457003Z","structure_string":"Mg2 Cd2\n1.0\n3.255190 0.000000 0.000000\n0.000000 4.976478 0.000000\n0.000000 0.000000 5.345630\nMg Cd\n2 2\ndirect\n0.500000 0.250000 0.316637 Mg\n0.500000 0.750000 0.683363 Mg\n0.000000 0.250000 0.817858 Cd\n0.000000 0.750000 0.182142 Cd\n","nsites":4,"nelements":2,"elements":["Mg","Cd"],"chemical_system":"Cd-Mg","density":5.243256571094555,"density_atomic":0.04619156371286203,"volume":86.59589930457801,"volume_molar":13.037317371273874,"formula_full":"Mg2 Cd2","formula_reduced":"MgCd","formula_anonymous":"AB","energy":-5.4401513,"energy_per_atom":-1.360037825,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.4401513,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0014779,"is_theoretical":false,"updated_at":"2021-11-28T01:34:28.909000Z","spacegroup":51},{"id":"mp-1097131","created_at":"2022-09-04T14:44:54.369516Z","structure_string":"Na1 Cd2 Rh1\n1.0\n-5.667862 5.727693 7.653738\n5.667862 -5.727693 7.653738\n5.667862 5.727693 -7.653738\nNa Cd Rh\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.268094 0.268094 Cd\n0.000000 0.731906 0.731906 Cd\n0.000000 0.500000 0.500000 Rh\n","nsites":4,"nelements":3,"elements":["Na","Cd","Rh"],"chemical_system":"Cd-Na-Rh","density":0.5859676847369844,"density_atomic":0.004024643424900351,"volume":993.876867513807,"volume_molar":149.63165985690043,"formula_full":"Na1 Cd2 Rh1","formula_reduced":"NaCd2Rh","formula_anonymous":"ABC2","energy":-5.4410846,"energy_per_atom":-1.36027115,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.4410846,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9742646,"is_theoretical":true,"updated_at":"2021-11-28T01:36:46.316000Z","spacegroup":71},{"id":"mp-22859","created_at":"2022-09-04T14:42:00.577617Z","structure_string":"Hg2 I2\n1.0\n-2.595266 2.595266 5.904167\n2.595266 -2.595266 5.904167\n2.595266 2.595266 -5.904167\nHg I\n2 2\ndirect\n0.887046 0.887046 0.000000 Hg\n0.112954 0.112954 0.000000 Hg\n0.652519 0.652519 0.000000 I\n0.347481 0.347481 0.000000 I\n","nsites":4,"nelements":2,"elements":["Hg","I"],"chemical_system":"Hg-I","density":6.8375526799081765,"density_atomic":0.02514650382130242,"volume":159.06783815456168,"volume_molar":23.948222793891727,"formula_full":"Hg2 I2","formula_reduced":"HgI","formula_anonymous":"AB","energy":-5.44163612,"energy_per_atom":-1.36040903,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.68363612,"band_gap":1.6426000000000005,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":2.96e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:35:36.923000Z","spacegroup":139},{"id":"mp-1179684","created_at":"2022-09-04T14:44:02.345536Z","structure_string":"Rb1 S1\n1.0\n6.433489 5.883228 0.000000\n-6.433489 5.883228 0.000000\n0.000000 2.113365 5.992079\nRb S\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.000000 0.000000 0.500000 S\n","nsites":2,"nelements":2,"elements":["Rb","S"],"chemical_system":"Rb-S","density":0.43026736970699225,"density_atomic":0.004409204350965699,"volume":453.5965767977985,"volume_molar":136.58112168652465,"formula_full":"Rb1 S1","formula_reduced":"RbS","formula_anonymous":"AB","energy":-5.44195915,"energy_per_atom":-2.720979575,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.93895915,"band_gap":0.3290999999999999,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.0000168,"is_theoretical":true,"updated_at":"2021-11-28T01:36:24.706000Z","spacegroup":12},{"id":"mp-1096118","created_at":"2022-09-04T14:41:55.351957Z","structure_string":"Sc1 Cd2 Ag1\n1.0\n-5.803700 6.042112 8.504609\n5.803700 -6.042112 8.504609\n5.803700 6.042112 -8.504609\nSc Cd Ag\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.261758 0.261758 Cd\n0.000000 0.738242 0.738242 Cd\n0.000000 0.500000 0.500000 Ag\n","nsites":4,"nelements":3,"elements":["Sc","Cd","Ag"],"chemical_system":"Ag-Cd-Sc","density":0.5256855578178379,"density_atomic":0.0033531418173553492,"volume":1192.91107202702,"volume_molar":179.59695974773035,"formula_full":"Sc1 Cd2 Ag1","formula_reduced":"ScCd2Ag","formula_anonymous":"ABC2","energy":-5.44203659,"energy_per_atom":-1.3605091475,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-5.44203659,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.999989,"is_theoretical":true,"updated_at":"2021-11-28T01:35:27.394000Z","spacegroup":71}]}