{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=density&page=26","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=density&page=24","results":[{"id":"mp-1096613","created_at":"2022-09-04T14:48:09.416241Z","structure_string":"Sr1 La1 Mg2\n1.0\n-5.999535 7.090681 8.502101\n5.999535 -7.090681 8.502101\n5.999535 7.090681 -8.502101\nSr La Mg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.000000 0.500000 La\n0.741224 0.000000 0.741224 Mg\n0.258776 0.000000 0.258776 Mg\n","nsites":4,"nelements":3,"elements":["Sr","La","Mg"],"chemical_system":"La-Mg-Sr","density":0.315794011479698,"density_atomic":0.0027648285245853665,"volume":1446.7443331227453,"volume_molar":217.81245044493755,"formula_full":"Sr1 La1 Mg2","formula_reduced":"SrLaMg2","formula_anonymous":"ABC2","energy":-2.5548613,"energy_per_atom":-0.638715325,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-2.5548613,"band_gap":0.0051000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.011209,"is_theoretical":true,"updated_at":"2021-11-28T01:38:31.078000Z","spacegroup":71},{"id":"mp-1096564","created_at":"2022-09-04T14:41:26.813087Z","structure_string":"Sr2 Zn1 Cd1\n1.0\n-6.718771 7.263720 9.499507\n6.718771 -7.263720 9.499507\n6.718771 7.263720 -9.499507\nSr Zn Cd\n2 1 1\ndirect\n0.752137 0.000000 0.752137 Sr\n0.247863 0.000000 0.247863 Sr\n0.000000 0.000000 0.000000 Zn\n0.500000 0.000000 0.500000 Cd\n","nsites":4,"nelements":3,"elements":["Sr","Zn","Cd"],"chemical_system":"Cd-Sr-Zn","density":0.3161459496254937,"density_atomic":0.0021569992749181795,"volume":1854.42806889758,"volume_molar":279.19067150490514,"formula_full":"Sr2 Zn1 Cd1","formula_reduced":"Sr2ZnCd","formula_anonymous":"ABC2","energy":-1.29006656,"energy_per_atom":-0.32251664,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-1.29006656,"band_gap":0.4788000000000001,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001194,"is_theoretical":true,"updated_at":"2021-11-28T01:35:21.110000Z","spacegroup":71},{"id":"mp-1097118","created_at":"2022-09-04T14:41:14.554542Z","structure_string":"Sc2 Al1 Ga1\n1.0\n-5.451718 5.620980 7.977579\n5.451718 -5.620980 7.977579\n5.451718 5.620980 -7.977579\nSc Al Ga\n2 1 1\ndirect\n0.000000 0.252048 0.252048 Sc\n0.000000 0.747952 0.747952 Sc\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Ga\n","nsites":4,"nelements":3,"elements":["Sc","Al","Ga"],"chemical_system":"Al-Ga-Sc","density":0.3169000368065123,"density_atomic":0.004090566556048619,"volume":977.8596546938711,"volume_molar":147.22021210228718,"formula_full":"Sc2 Al1 Ga1","formula_reduced":"Sc2AlGa","formula_anonymous":"ABC2","energy":-10.65123567,"energy_per_atom":-2.6628089175,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-10.65123567,"band_gap":0.1660999999999997,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.0479855,"is_theoretical":true,"updated_at":"2021-11-28T01:35:17.066000Z","spacegroup":71},{"id":"mp-1215080","created_at":"2022-09-04T14:39:07.800906Z","structure_string":"Ag12 S1 Br1\n1.0\n19.427257 0.000000 0.000000\n0.000000 19.427257 0.000000\n0.000000 0.000000 19.427257\nAg S Br\n12 1 1\ndirect\n0.097807 0.500000 0.000000 Ag\n0.902193 0.500000 0.000000 Ag\n0.000000 0.097807 0.500000 Ag\n0.500000 0.097807 0.000000 Ag\n0.000000 0.902193 0.500000 Ag\n0.500000 0.902193 0.000000 Ag\n0.500000 0.000000 0.097807 Ag\n0.097807 0.000000 0.500000 Ag\n0.500000 0.000000 0.902193 Ag\n0.902193 0.000000 0.500000 Ag\n0.000000 0.500000 0.097807 Ag\n0.000000 0.500000 0.902193 Ag\n0.000000 0.000000 0.000000 S\n0.500000 0.500000 0.500000 Br\n","nsites":14,"nelements":3,"elements":["Ag","S","Br"],"chemical_system":"Ag-Br-S","density":0.31850745949852477,"density_atomic":0.0019093853207317948,"volume":7332.202593154079,"volume_molar":315.39682926293483,"formula_full":"Ag12 S1 Br1","formula_reduced":"Ag12SBr","formula_anonymous":"ABC12","energy":-18.00708367,"energy_per_atom":-1.2862202621428571,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-16.97008367,"band_gap":0.3277000000000001,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":5.0875149,"is_theoretical":true,"updated_at":"2021-11-28T01:34:30.016000Z","spacegroup":221},{"id":"mp-1097332","created_at":"2022-09-04T14:42:41.469779Z","structure_string":"Li2 Ca1 Tl1\n1.0\n-6.068685 6.347169 8.736742\n6.068685 -6.347169 8.736742\n6.068685 6.347169 -8.736742\nLi Ca Tl\n2 1 1\ndirect\n0.272300 0.000000 0.272300 Li\n0.727700 0.000000 0.727700 Li\n0.000000 0.000000 0.000000 Ca\n0.500000 0.000000 0.500000 Tl\n","nsites":4,"nelements":3,"elements":["Li","Ca","Tl"],"chemical_system":"Ca-Li-Tl","density":0.3186853800317066,"density_atomic":0.002971500661899502,"volume":1346.1211876167108,"volume_molar":202.66328179615502,"formula_full":"Li2 Ca1 Tl1","formula_reduced":"Li2CaTl","formula_anonymous":"ABC2","energy":-3.75095977,"energy_per_atom":-0.9377399425,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-3.75095977,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.9998575,"is_theoretical":true,"updated_at":"2021-11-28T01:35:50.538000Z","spacegroup":71},{"id":"mp-1096214","created_at":"2022-09-04T14:42:24.034429Z","structure_string":"Ca2 Mg1 Pb1\n1.0\n-6.482277 6.656142 9.405301\n6.482277 -6.656142 9.405301\n6.482277 6.656142 -9.405301\nCa Mg Pb\n2 1 1\ndirect\n0.000000 0.268108 0.268108 Ca\n0.000000 0.731892 0.731892 Ca\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Pb\n","nsites":4,"nelements":3,"elements":["Ca","Mg","Pb"],"chemical_system":"Ca-Mg-Pb","density":0.3188223093527739,"density_atomic":0.0024642067182152113,"volume":1623.2404410037243,"volume_molar":244.38456057622258,"formula_full":"Ca2 Mg1 Pb1","formula_reduced":"Ca2MgPb","formula_anonymous":"ABC2","energy":-4.18225669,"energy_per_atom":-1.0455641725,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.18225669,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0002599,"is_theoretical":true,"updated_at":"2021-11-28T01:35:44.145000Z","spacegroup":71},{"id":"mp-1096181","created_at":"2022-09-04T14:41:10.401644Z","structure_string":"Ca2 Ga1 Ag1\n1.0\n-5.948416 6.313936 8.927113\n5.948416 -6.313936 8.927113\n5.948416 6.313936 -8.927113\nCa Ga Ag\n2 1 1\ndirect\n0.000000 0.247694 0.247694 Ca\n0.000000 0.752306 0.752306 Ca\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500000 Ag\n","nsites":4,"nelements":3,"elements":["Ca","Ga","Ag"],"chemical_system":"Ag-Ca-Ga","density":0.3191321231457882,"density_atomic":0.0029825481204618226,"volume":1341.1351094582285,"volume_molar":201.9126101833865,"formula_full":"Ca2 Ga1 Ag1","formula_reduced":"Ca2GaAg","formula_anonymous":"ABC2","energy":-4.98475827,"energy_per_atom":-1.2461895675,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-4.98475827,"band_gap":0.0064999999999999,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0002725,"is_theoretical":true,"updated_at":"2021-11-28T01:35:10.932000Z","spacegroup":71},{"id":"mp-1206473","created_at":"2022-09-04T14:46:12.504078Z","structure_string":"Pr2 Zn1 Sb3\n1.0\n9.486870 0.000000 0.000000\n0.000000 9.486870 0.000000\n0.000000 0.000000 41.142718\nPr Zn Sb\n2 1 3\ndirect\n0.500000 0.500000 0.242785 Pr\n0.500000 0.500000 0.757215 Pr\n0.500000 0.500000 0.500000 Zn\n0.500000 0.500000 0.690792 Sb\n0.500000 0.500000 0.309208 Sb\n0.500000 0.500000 0.000000 Sb\n","nsites":6,"nelements":3,"elements":["Pr","Zn","Sb"],"chemical_system":"Pr-Sb-Zn","density":0.3195197511753382,"density_atomic":0.0016203632044126794,"volume":3702.8735185175806,"volume_molar":371.65375908315565,"formula_full":"Pr2 Zn1 Sb3","formula_reduced":"Pr2ZnSb3","formula_anonymous":"AB2C3","energy":-12.0693538,"energy_per_atom":-2.0115589666666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-11.4933538,"band_gap":0.1044,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":3.1440606,"is_theoretical":true,"updated_at":"2021-11-28T01:37:27.816000Z","spacegroup":123},{"id":"mp-1097602","created_at":"2022-09-04T14:41:10.758351Z","structure_string":"La2 Mg1 Al1\n1.0\n-6.137076 7.376686 9.443863\n6.137076 -7.376686 9.443863\n6.137076 7.376686 -9.443863\nLa Mg Al\n2 1 1\ndirect\n0.000000 0.267876 0.267876 La\n0.000000 0.732124 0.732124 La\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Al\n","nsites":4,"nelements":3,"elements":["La","Mg","Al"],"chemical_system":"Al-La-Mg","density":0.319551737941436,"density_atomic":0.0023389854639269013,"volume":1710.1431632176273,"volume_molar":257.46807121620515,"formula_full":"La2 Mg1 Al1","formula_reduced":"La2MgAl","formula_anonymous":"ABC2","energy":-6.27040001,"energy_per_atom":-1.5676000025,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.27040001,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.0014806,"is_theoretical":true,"updated_at":"2021-11-28T01:35:15.302000Z","spacegroup":71},{"id":"mp-1097626","created_at":"2022-09-04T14:44:59.028696Z","structure_string":"Y2 Mg1 Zn1\n1.0\n-6.102177 6.350623 8.965326\n6.102177 -6.350623 8.965326\n6.102177 6.350623 -8.965326\nY Mg Zn\n2 1 1\ndirect\n0.000000 0.264324 0.264324 Y\n0.000000 0.735676 0.735676 Y\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 Zn\n","nsites":4,"nelements":3,"elements":["Y","Mg","Zn"],"chemical_system":"Mg-Y-Zn","density":0.31965933857929446,"density_atomic":0.0028782782855452916,"volume":1389.7196876646685,"volume_molar":209.22718940149676,"formula_full":"Y2 Mg1 Zn1","formula_reduced":"Y2MgZn","formula_anonymous":"ABC2","energy":-6.80531463,"energy_per_atom":-1.7013286575,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-6.80531463,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0001584,"is_theoretical":true,"updated_at":"2021-11-28T01:36:46.909000Z","spacegroup":71},{"id":"mp-1096069","created_at":"2022-09-04T14:40:31.812405Z","structure_string":"Ba2 Na1 In1\n1.0\n-7.195333 7.255329 10.248390\n7.195333 -7.255329 10.248390\n7.195333 7.255329 -10.248390\nBa Na In\n2 1 1\ndirect\n0.000000 0.268231 0.268231 Ba\n0.000000 0.731769 0.731769 Ba\n0.000000 0.000000 0.000000 Na\n0.000000 0.500000 0.500000 In\n","nsites":4,"nelements":3,"elements":["Ba","Na","In"],"chemical_system":"Ba-In-Na","density":0.3200436051318614,"density_atomic":0.001869116396869836,"volume":2140.048638329161,"volume_molar":322.1918533316135,"formula_full":"Ba2 Na1 In1","formula_reduced":"Ba2NaIn","formula_anonymous":"ABC2","energy":-3.58585173,"energy_per_atom":-0.8964629325,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-3.58585173,"band_gap":0.1417000000000001,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":1.9997777,"is_theoretical":true,"updated_at":"2021-11-28T01:34:56.999000Z","spacegroup":71},{"id":"mp-1207532","created_at":"2022-09-04T14:42:55.439057Z","structure_string":"Zr2 Cu1 Sn3\n1.0\n8.987911 0.000000 0.000000\n0.000000 8.987911 0.000000\n0.000000 0.000000 38.670931\nZr Cu Sn\n2 1 3\ndirect\n0.500000 0.500000 0.251613 Zr\n0.500000 0.500000 0.748387 Zr\n0.500000 0.500000 0.500000 Cu\n0.500000 0.500000 0.675783 Sn\n0.500000 0.500000 0.324217 Sn\n0.500000 0.500000 0.000000 Sn\n","nsites":6,"nelements":3,"elements":["Zr","Cu","Sn"],"chemical_system":"Cu-Sn-Zr","density":0.3200610908596486,"density_atomic":0.0019206538270741974,"volume":3123.936190594023,"volume_molar":313.54639108358987,"formula_full":"Zr2 Cu1 Sn3","formula_reduced":"Zr2CuSn3","formula_anonymous":"AB2C3","energy":-13.02978642,"energy_per_atom":-2.17163107,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.02978642,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":10.9352063,"is_theoretical":true,"updated_at":"2021-11-28T01:35:58.051000Z","spacegroup":123}]}