{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-band_gap&page=12121","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=-band_gap&page=12119","results":[{"id":"mp-19774","created_at":"2022-09-04T14:47:09.458742Z","structure_string":"Eu1 Cd2 Sb2\n1.0\n2.383995 -4.129200 0.000000\n2.383995 4.129200 0.000000\n0.000000 0.000000 7.700333\nEu Cd Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Eu\n0.666667 0.333333 0.366036 Cd\n0.333333 0.666667 0.633964 Cd\n0.666667 0.333333 0.756232 Sb\n0.333333 0.666667 0.243768 Sb\n","nsites":5,"nelements":3,"elements":["Eu","Cd","Sb"],"chemical_system":"Cd-Eu-Sb","density":6.794293729776883,"density_atomic":0.032980652468008985,"volume":151.60403527037457,"volume_molar":18.259616803644004,"formula_full":"Eu1 Cd2 Sb2","formula_reduced":"Eu(CdSb)2","formula_anonymous":"AB2C2","energy":-23.238649980000005,"energy_per_atom":-4.647729996000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-22.85464998,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.965938,"is_theoretical":false,"updated_at":"2021-11-28T01:37:53.820000Z","spacegroup":164},{"id":"mp-1246431","created_at":"2022-09-04T14:47:09.468859Z","structure_string":"Mg2 Al2 V2 S8\n1.0\n6.277199 -0.001257 3.621927\n2.042246 5.923583 3.706751\n-0.015880 0.092648 7.271381\nMg Al V S\n2 2 2 8\ndirect\n0.874215 0.876338 0.875429 Mg\n0.125798 0.123658 0.124570 Mg\n0.499995 0.500006 0.499995 Al\n-0.000004 0.499995 0.500009 Al\n0.500017 0.500000 -0.000012 V\n0.500013 0.999999 0.499998 V\n0.746158 0.734179 0.734826 S\n0.262737 0.261377 0.713173 S\n0.262840 0.713441 0.260934 S\n0.715191 0.265804 0.265098 S\n0.737150 0.286554 0.739061 S\n0.284801 0.734190 0.734915 S\n0.253832 0.265821 0.265183 S\n0.737260 0.738632 0.286821 S\n","nsites":14,"nelements":4,"elements":["Mg","Al","V","S"],"chemical_system":"Al-Mg-S-V","density":2.842813870698229,"density_atomic":0.051993490749497814,"volume":269.26447519077607,"volume_molar":11.582489794759868,"formula_full":"Mg2 Al2 V2 S8","formula_reduced":"MgAlVS4","formula_anonymous":"ABCD4","energy":-80.96923313,"energy_per_atom":-5.783516652142858,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-76.94523313,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":4.0000004,"is_theoretical":true,"updated_at":"2021-11-28T01:37:59.004000Z","spacegroup":74},{"id":"mp-30526","created_at":"2022-09-04T14:47:09.468935Z","structure_string":"Mn24 Al114\n1.0\n12.712676 0.000000 0.000000\n0.000000 12.712676 0.000000\n0.000000 0.000000 12.712676\nMn Al\n24 114\ndirect\n0.327709 0.202787 0.000000 Mn\n0.000000 0.327709 0.202787 Mn\n0.202787 0.000000 0.327709 Mn\n0.797213 0.000000 0.327709 Mn\n0.000000 0.672291 0.797213 Mn\n0.797213 0.000000 0.672291 Mn\n0.000000 0.672291 0.202787 Mn\n0.000000 0.327709 0.797213 Mn\n0.202787 0.000000 0.672291 Mn\n0.327709 0.797213 0.000000 Mn\n0.672291 0.202787 0.000000 Mn\n0.672291 0.797213 0.000000 Mn\n0.175124 0.296991 0.500000 Mn\n0.500000 0.175124 0.296991 Mn\n0.296991 0.500000 0.175124 Mn\n0.703009 0.500000 0.175124 Mn\n0.500000 0.824876 0.703009 Mn\n0.703009 0.500000 0.824876 Mn\n0.500000 0.824876 0.296991 Mn\n0.500000 0.175124 0.703009 Mn\n0.296991 0.500000 0.824876 Mn\n0.175124 0.703009 0.500000 Mn\n0.824876 0.296991 0.500000 Mn\n0.824876 0.703009 0.500000 Mn\n0.362522 0.000000 0.000000 Al\n0.000000 0.362522 0.000000 Al\n0.000000 0.000000 0.362522 Al\n0.000000 0.637478 0.000000 Al\n0.000000 0.000000 0.637478 Al\n0.637478 0.000000 0.000000 Al\n0.118546 0.500000 0.500000 Al\n0.500000 0.118546 0.500000 Al\n0.500000 0.500000 0.118546 Al\n0.500000 0.881454 0.500000 Al\n0.500000 0.500000 0.881454 Al\n0.881454 0.500000 0.500000 Al\n0.301180 0.000000 0.500000 Al\n0.500000 0.301180 0.000000 Al\n0.000000 0.500000 0.301180 Al\n0.500000 0.698820 0.000000 Al\n0.000000 0.500000 0.698820 Al\n0.698820 0.000000 0.500000 Al\n0.168763 0.105027 0.000000 Al\n0.000000 0.168763 0.105027 Al\n0.105027 0.000000 0.168763 Al\n0.894973 0.000000 0.168763 Al\n0.000000 0.831237 0.894973 Al\n0.894973 0.000000 0.831237 Al\n0.000000 0.831237 0.105027 Al\n0.000000 0.168763 0.894973 Al\n0.105027 0.000000 0.831237 Al\n0.168763 0.894973 0.000000 Al\n0.831237 0.105027 0.000000 Al\n0.831237 0.894973 0.000000 Al\n0.329076 0.395690 0.500000 Al\n0.500000 0.329076 0.395690 Al\n0.395690 0.500000 0.329076 Al\n0.604310 0.500000 0.329076 Al\n0.500000 0.670924 0.604310 Al\n0.604310 0.500000 0.670924 Al\n0.500000 0.670924 0.395690 Al\n0.500000 0.329076 0.604310 Al\n0.395690 0.500000 0.670924 Al\n0.329076 0.604310 0.500000 Al\n0.670924 0.395690 0.500000 Al\n0.670924 0.604310 0.500000 Al\n0.321630 0.403185 0.000000 Al\n0.000000 0.321630 0.403185 Al\n0.403185 0.000000 0.321630 Al\n0.596815 0.000000 0.321630 Al\n0.000000 0.678370 0.596815 Al\n0.596815 0.000000 0.678370 Al\n0.000000 0.678370 0.403185 Al\n0.000000 0.321630 0.596815 Al\n0.403185 0.000000 0.678370 Al\n0.321630 0.596815 0.000000 Al\n0.678370 0.403185 0.000000 Al\n0.678370 0.596815 0.000000 Al\n0.126206 0.110119 0.500000 Al\n0.500000 0.126206 0.110119 Al\n0.110119 0.500000 0.126206 Al\n0.889881 0.500000 0.126206 Al\n0.500000 0.873794 0.889881 Al\n0.889881 0.500000 0.873794 Al\n0.500000 0.873794 0.110119 Al\n0.500000 0.126206 0.889881 Al\n0.110119 0.500000 0.873794 Al\n0.126206 0.889881 0.500000 Al\n0.873794 0.110119 0.500000 Al\n0.873794 0.889881 0.500000 Al\n0.118838 0.185841 0.300390 Al\n0.300390 0.118838 0.185841 Al\n0.185841 0.300390 0.118838 Al\n0.814159 0.699610 0.118838 Al\n0.300390 0.881162 0.814159 Al\n0.814159 0.300390 0.881162 Al\n0.699610 0.881162 0.185841 Al\n0.699610 0.118838 0.814159 Al\n0.185841 0.699610 0.881162 Al\n0.118838 0.814159 0.699610 Al\n0.881162 0.185841 0.699610 Al\n0.881162 0.814159 0.300390 Al\n0.881162 0.814159 0.699610 Al\n0.699610 0.881162 0.814159 Al\n0.814159 0.699610 0.881162 Al\n0.185841 0.300390 0.881162 Al\n0.699610 0.118838 0.185841 Al\n0.185841 0.699610 0.118838 Al\n0.300390 0.118838 0.814159 Al\n0.300390 0.881162 0.185841 Al\n0.814159 0.300390 0.118838 Al\n0.881162 0.185841 0.300390 Al\n0.118838 0.814159 0.300390 Al\n0.118838 0.185841 0.699610 Al\n0.388148 0.315004 0.194276 Al\n0.194276 0.388148 0.315004 Al\n0.315004 0.194276 0.388148 Al\n0.684996 0.805724 0.388148 Al\n0.194276 0.611852 0.684996 Al\n0.684996 0.194276 0.611852 Al\n0.805724 0.611852 0.315004 Al\n0.805724 0.388148 0.684996 Al\n0.315004 0.805724 0.611852 Al\n0.388148 0.684996 0.805724 Al\n0.611852 0.315004 0.805724 Al\n0.611852 0.684996 0.194276 Al\n0.611852 0.684996 0.805724 Al\n0.805724 0.611852 0.684996 Al\n0.684996 0.805724 0.611852 Al\n0.315004 0.194276 0.611852 Al\n0.805724 0.388148 0.315004 Al\n0.315004 0.805724 0.388148 Al\n0.194276 0.388148 0.684996 Al\n0.194276 0.611852 0.315004 Al\n0.684996 0.194276 0.388148 Al\n0.611852 0.315004 0.194276 Al\n0.388148 0.684996 0.194276 Al\n0.388148 0.315004 0.805724 Al\n","nsites":138,"nelements":2,"elements":["Mn","Al"],"chemical_system":"Al-Mn","density":3.551718897050444,"density_atomic":0.06716888680758103,"volume":2054.5226601019776,"volume_molar":8.965670038944744,"formula_full":"Mn24 Al114","formula_reduced":"Mn4Al19","formula_anonymous":"A4B19","energy":-672.51708066,"energy_per_atom":-4.873312178695652,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-672.51708066,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0359863,"is_theoretical":false,"updated_at":"2021-11-28T01:37:52.121000Z","spacegroup":200},{"id":"mp-1175704","created_at":"2022-09-04T14:47:09.474771Z","structure_string":"Li9 Mn2 Co5 O16\n1.0\n2.980765 0.000000 0.000000\n1.180961 7.679944 0.000000\n0.064914 0.125903 12.562142\nLi Mn Co O\n9 2 5 16\ndirect\n0.058871 0.375458 0.689363 Li\n0.814215 0.874424 0.940459 Li\n0.557644 0.380645 0.181245 Li\n0.690377 0.123222 0.564543 Li\n0.442356 0.619355 0.818755 Li\n0.185785 0.125576 0.059541 Li\n0.309623 0.876778 0.435457 Li\n0.941129 0.624542 0.310637 Li\n0.000000 0.500000 0.000000 Li\n0.876115 0.747119 0.626548 Mn\n0.123885 0.252881 0.373452 Mn\n0.619344 0.263338 0.880158 Co\n0.380656 0.736662 0.119842 Co\n0.500000 0.500000 0.500000 Co\n0.244938 0.003014 0.755633 Co\n0.755062 0.996986 0.244367 Co\n0.500828 0.566294 0.647888 O\n0.246926 0.069561 0.898109 O\n0.984575 0.573824 0.153738 O\n0.066307 0.333875 0.523033 O\n0.828328 0.817621 0.775205 O\n0.602553 0.302841 0.017451 O\n0.755682 0.064302 0.398136 O\n0.335657 0.816804 0.268971 O\n0.664343 0.183196 0.731029 O\n0.397447 0.697159 0.982549 O\n0.171672 0.182379 0.224795 O\n0.244318 0.935698 0.601864 O\n0.015425 0.426176 0.846262 O\n0.753074 0.930439 0.101891 O\n0.933693 0.666125 0.476967 O\n0.499172 0.433706 0.352112 O\n","nsites":32,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.1748298987350285,"density_atomic":0.11127573937262647,"volume":287.57391485705926,"volume_molar":5.411908106792082,"formula_full":"Li9 Mn2 Co5 O16","formula_reduced":"Li9Mn2Co5O16","formula_anonymous":"A2B5C9D16","energy":-207.75521875,"energy_per_atom":-6.4923505859375,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-185.23721875,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":13.9999799,"is_theoretical":true,"updated_at":"2021-11-28T01:37:54.759000Z","spacegroup":2},{"id":"mp-1079176","created_at":"2022-09-04T14:47:09.485399Z","structure_string":"Sm2 Fe2 Se2 O3\n1.0\n-2.027391 2.027391 9.394274\n2.027391 -2.027391 9.394274\n2.027392 2.027391 -9.394274\nSm Fe Se O\n2 2 2 3\ndirect\n0.310312 0.310312 0.000000 Sm\n0.689688 0.689688 0.000000 Sm\n0.500000 0.000000 0.500000 Fe\n0.000000 0.500000 0.500000 Fe\n0.899419 0.899419 0.000000 Se\n0.100581 0.100581 0.000000 Se\n0.250000 0.750000 0.500000 O\n0.750000 0.250000 0.500000 O\n0.500000 0.500000 0.000000 O\n","nsites":9,"nelements":4,"elements":["Sm","Fe","Se","O"],"chemical_system":"Fe-O-Se-Sm","density":6.647675342511287,"density_atomic":0.05826988480858051,"volume":154.4537118884901,"volume_molar":10.334911043299696,"formula_full":"Sm2 Fe2 Se2 O3","formula_reduced":"Sm2Fe2Se2O3","formula_anonymous":"A2B2C2D3","energy":-68.89090345,"energy_per_atom":-7.6545448277777774,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-61.37390345,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":7.9996571,"is_theoretical":false,"updated_at":"2021-11-28T01:37:58.856000Z","spacegroup":139},{"id":"mp-1080590","created_at":"2022-09-04T14:47:09.487398Z","structure_string":"Dy2 Au6\n1.0\n5.067615 0.000000 0.000000\n0.000000 5.172740 0.000000\n0.000000 0.000000 6.179115\nDy Au\n2 6\ndirect\n0.500000 0.655023 0.500000 Dy\n0.000000 0.344977 0.000000 Dy\n0.500000 0.157983 0.755093 Au\n0.500000 0.157983 0.244907 Au\n0.000000 0.842017 0.744907 Au\n0.000000 0.842017 0.255093 Au\n0.000000 0.338764 0.500000 Au\n0.500000 0.661236 0.000000 Au\n","nsites":8,"nelements":2,"elements":["Dy","Au"],"chemical_system":"Au-Dy","density":15.44735044864608,"density_atomic":0.049390047773375995,"volume":161.97595184980665,"volume_molar":12.193024772181476,"formula_full":"Dy2 Au6","formula_reduced":"DyAu3","formula_anonymous":"AB3","energy":-34.60894053,"energy_per_atom":-4.32611756625,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-34.60894053,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":2.4e-06,"is_theoretical":false,"updated_at":"2021-11-28T01:37:57.009000Z","spacegroup":59},{"id":"mp-22037","created_at":"2022-09-04T14:47:09.507477Z","structure_string":"Cu6 Pb1 O8\n1.0\n0.000000 4.314345 4.314345\n4.314345 0.000000 4.314345\n4.314345 4.314345 0.000000\nCu Pb O\n6 1 8\ndirect\n0.000000 0.500000 0.000000 Cu\n0.500000 0.500000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 0.000000 0.500000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 0.000000 Cu\n0.000000 0.000000 0.000000 Pb\n0.750000 0.750000 0.750000 O\n0.251518 0.251518 0.748482 O\n0.251518 0.748482 0.748482 O\n0.748482 0.251518 0.251518 O\n0.251518 0.748482 0.251518 O\n0.748482 0.251518 0.748482 O\n0.250000 0.250000 0.250000 O\n0.748482 0.748482 0.251518 O\n","nsites":15,"nelements":3,"elements":["Cu","Pb","O"],"chemical_system":"Cu-O-Pb","density":7.4075267244531,"density_atomic":0.09339349990662768,"volume":160.61074930264525,"volume_molar":6.448136932464011,"formula_full":"Cu6 Pb1 O8","formula_reduced":"Cu6PbO8","formula_anonymous":"AB6C8","energy":-79.62500401,"energy_per_atom":-5.308333600666667,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-74.12900401,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0085317,"is_theoretical":false,"updated_at":"2021-11-28T01:37:57.979000Z","spacegroup":225},{"id":"mp-1226615","created_at":"2022-09-04T14:47:10.724301Z","structure_string":"Ce2 Ge2 Pd2\n1.0\n2.230805 5.202360 0.000000\n-2.230805 5.202360 0.000000\n0.000000 4.893631 5.370861\nCe Ge Pd\n2 2 2\ndirect\n0.461438 0.461438 0.300566 Ce\n0.538562 0.538562 0.699434 Ce\n0.158706 0.158706 0.899481 Ge\n0.841294 0.841294 0.100519 Ge\n0.822003 0.822003 0.714794 Pd\n0.177997 0.177997 0.285206 Pd\n","nsites":6,"nelements":3,"elements":["Ce","Ge","Pd"],"chemical_system":"Ce-Ge-Pd","density":8.503023931011345,"density_atomic":0.048129941175929274,"volume":124.66252510195706,"volume_molar":12.512254561016977,"formula_full":"Ce2 Ge2 Pd2","formula_reduced":"CeGePd","formula_anonymous":"ABC","energy":-36.42725803,"energy_per_atom":-6.071209671666666,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-36.42725803,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0001348,"is_theoretical":true,"updated_at":"2021-11-28T01:37:59.799000Z","spacegroup":12},{"id":"mp-1223895","created_at":"2022-09-04T14:47:09.508798Z","structure_string":"Ho1 Sc1 B8 Rh8\n1.0\n5.330797 0.000000 0.000000\n0.000000 5.330797 0.000000\n0.000000 0.000000 7.411042\nHo Sc B Rh\n1 1 8 8\ndirect\n0.500000 0.500000 0.000000 Ho\n0.000000 0.000000 0.500000 Sc\n0.331389 0.000000 0.149978 B\n0.668611 0.000000 0.149978 B\n0.500000 0.829793 0.649398 B\n0.500000 0.170207 0.649398 B\n0.170207 0.500000 0.350602 B\n0.829793 0.500000 0.350602 B\n0.000000 0.668611 0.850022 B\n0.000000 0.331389 0.850022 B\n0.752380 0.000000 0.851029 Rh\n0.247620 0.000000 0.851029 Rh\n0.500000 0.250142 0.356497 Rh\n0.500000 0.749858 0.356497 Rh\n0.749858 0.500000 0.643503 Rh\n0.250142 0.500000 0.643503 Rh\n0.000000 0.247620 0.148971 Rh\n0.000000 0.752380 0.148971 Rh\n","nsites":18,"nelements":4,"elements":["Ho","Sc","B","Rh"],"chemical_system":"B-Ho-Rh-Sc","density":8.827861189203322,"density_atomic":0.08546906270555575,"volume":210.6025201424134,"volume_molar":7.04598900393527,"formula_full":"Ho1 Sc1 B8 Rh8","formula_reduced":"HoSc(BRh)8","formula_anonymous":"ABC8D8","energy":-133.24655574,"energy_per_atom":-7.4025864299999995,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-133.24655574,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0008081,"is_theoretical":true,"updated_at":"2021-11-28T01:37:55.545000Z","spacegroup":115},{"id":"mp-56","created_at":"2022-09-04T14:47:09.513897Z","structure_string":"Ba2\n1.0\n2.239279 -3.878544 0.000000\n2.239279 3.878544 0.000000\n0.000000 0.000000 7.352020\nBa\n2\ndirect\n0.333333 0.666667 0.250000 Ba\n0.666667 0.333333 0.750000 Ba\n","nsites":2,"nelements":1,"elements":["Ba"],"chemical_system":"Ba","density":3.571259596639392,"density_atomic":0.01566088823676005,"volume":127.70667728191151,"volume_molar":38.45337932917826,"formula_full":"Ba2","formula_reduced":"Ba","formula_anonymous":"A","energy":-3.80600479,"energy_per_atom":-1.903002395,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-3.80600479,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0021444,"is_theoretical":false,"updated_at":"2021-11-28T01:37:53.281000Z","spacegroup":194},{"id":"mp-1210764","created_at":"2022-09-04T14:47:09.520874Z","structure_string":"N16 F8\n1.0\n4.380955 0.000000 0.000000\n0.000000 7.846785 0.000000\n0.000000 0.000000 12.348252\nN F\n16 8\ndirect\n0.132617 0.491057 0.435215 N\n0.367383 0.508943 0.935215 N\n0.867383 0.991057 0.064785 N\n0.632617 0.008943 0.564785 N\n0.231660 0.681171 0.202918 N\n0.268340 0.318829 0.702918 N\n0.768340 0.181171 0.297082 N\n0.731660 0.818829 0.797082 N\n0.094379 0.055400 0.070302 N\n0.405621 0.944600 0.570302 N\n0.905621 0.555400 0.429698 N\n0.594379 0.444600 0.929698 N\n0.196219 0.200589 0.746322 N\n0.303781 0.799411 0.246322 N\n0.803781 0.700589 0.753678 N\n0.696219 0.299411 0.253678 N\n0.202366 0.294503 0.105762 F\n0.297634 0.705497 0.605762 F\n0.797634 0.794503 0.394238 F\n0.702366 0.205497 0.894238 F\n0.134872 0.127698 0.387190 F\n0.365128 0.872302 0.887190 F\n0.865128 0.627698 0.112810 F\n0.634872 0.372302 0.612810 F\n","nsites":24,"nelements":2,"elements":["N","F"],"chemical_system":"F-N","density":1.4712279420694059,"density_atomic":0.056538621094088734,"volume":424.4885979808458,"volume_molar":10.65137536689877,"formula_full":"N16 F8","formula_reduced":"N2F","formula_anonymous":"AB2","energy":-144.68473113,"energy_per_atom":-6.028530463749999,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-140.98873113,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":8.0128155,"is_theoretical":true,"updated_at":"2021-11-28T01:37:47.997000Z","spacegroup":19},{"id":"mp-2424","created_at":"2022-09-04T14:47:09.529775Z","structure_string":"La1 Zn5\n1.0\n2.730869 -4.730004 0.000000\n2.730869 4.730004 0.000000\n0.000000 0.000000 4.298658\nLa Zn\n1 5\ndirect\n0.000000 0.000000 0.000000 La\n0.000000 0.500000 0.500000 Zn\n0.333333 0.666667 0.000000 Zn\n0.666667 0.333333 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.500000 Zn\n","nsites":6,"nelements":2,"elements":["La","Zn"],"chemical_system":"La-Zn","density":6.9672851664330215,"density_atomic":0.05402888251425453,"volume":111.0517138387419,"volume_molar":11.146150872935726,"formula_full":"La1 Zn5","formula_reduced":"LaZn5","formula_anonymous":"AB5","energy":-13.11636014,"energy_per_atom":-2.1860600233333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.11636014,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0013139,"is_theoretical":false,"updated_at":"2021-11-28T01:37:59.290000Z","spacegroup":191}]}