{"count":146323,"next":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_theoretical&page=3","previous":"https://simmate.org/third-parties/MatprojStructure/?format=json&ordering=is_theoretical","results":[{"id":"mp-5448","created_at":"2022-09-04T14:45:56.660864Z","structure_string":"Pr6 Sb2 O14\n1.0\n3.835894 -5.533794 0.000000\n3.835894 5.533794 0.000000\n0.000000 0.000000 7.776625\nPr Sb O\n6 2 14\ndirect\n0.481410 0.935267 0.750000 Pr\n0.518590 0.064733 0.250000 Pr\n0.935267 0.481410 0.750000 Pr\n0.064733 0.518590 0.250000 Pr\n0.000000 0.000000 0.500000 Pr\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 Sb\n0.500000 0.500000 0.000000 Sb\n0.579397 0.579397 0.750000 O\n0.420603 0.420603 0.250000 O\n0.848354 0.112065 0.750000 O\n0.151646 0.887935 0.250000 O\n0.112065 0.848354 0.750000 O\n0.887935 0.151646 0.250000 O\n0.440049 0.188409 0.966917 O\n0.559951 0.811591 0.466917 O\n0.188409 0.440049 0.966917 O\n0.811591 0.559951 0.466917 O\n0.440049 0.188409 0.533083 O\n0.559951 0.811591 0.033083 O\n0.811591 0.559951 0.033083 O\n0.188409 0.440049 0.533083 O\n","nsites":22,"nelements":3,"elements":["Pr","Sb","O"],"chemical_system":"O-Pr-Sb","density":6.603725726619944,"density_atomic":0.06663646381222534,"volume":330.1495718919558,"volume_molar":9.037305426304988,"formula_full":"Pr6 Sb2 O14","formula_reduced":"Pr3SbO7","formula_anonymous":"AB3C7","energy":-178.14744703999995,"energy_per_atom":-8.097611229090907,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-168.52944704,"band_gap":2.7314000000000003,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.17e-05,"is_theoretical":false,"updated_at":"2021-11-28T01:37:07.705000Z","spacegroup":63},{"id":"mp-555524","created_at":"2022-09-04T14:45:55.529905Z","structure_string":"Na8 Mg2 C12 S12 N12\n1.0\n4.373226 -7.574649 0.000000\n4.373226 7.574649 0.000000\n0.000000 0.000000 14.084798\nNa Mg C S N\n8 2 12 12 12\ndirect\n0.333333 0.666667 0.974826 Na\n0.666667 0.333333 0.474826 Na\n0.666667 0.333333 0.025174 Na\n0.333333 0.666667 0.525174 Na\n0.000000 0.000000 0.000000 Na\n0.333333 0.666667 0.250000 Na\n0.000000 0.000000 0.500000 Na\n0.666667 0.333333 0.750000 Na\n0.666667 0.333333 0.250000 Mg\n0.333333 0.666667 0.750000 Mg\n0.342032 0.998728 0.364322 C\n0.657968 0.001272 0.635678 C\n0.343304 0.001272 0.864322 C\n0.998728 0.656696 0.635678 C\n0.001272 0.343304 0.364322 C\n0.343304 0.342032 0.635678 C\n0.998728 0.342032 0.864322 C\n0.656696 0.998728 0.135678 C\n0.001272 0.657968 0.135678 C\n0.657968 0.656696 0.864322 C\n0.656696 0.657968 0.364322 C\n0.342032 0.343304 0.135678 C\n0.166172 0.812906 0.392109 S\n0.646735 0.812906 0.107891 S\n0.833828 0.187094 0.607891 S\n0.187094 0.353265 0.392109 S\n0.646735 0.833828 0.392109 S\n0.166172 0.353265 0.107891 S\n0.833828 0.646735 0.892109 S\n0.353265 0.166172 0.607891 S\n0.812906 0.646735 0.607891 S\n0.812906 0.166172 0.892109 S\n0.353265 0.187094 0.892109 S\n0.187094 0.833828 0.107891 S\n0.337240 0.867373 0.842883 N\n0.530133 0.662760 0.842883 N\n0.132627 0.662760 0.657117 N\n0.867373 0.530133 0.157117 N\n0.530133 0.867373 0.657117 N\n0.132627 0.469867 0.842883 N\n0.867373 0.337240 0.342883 N\n0.337240 0.469867 0.657117 N\n0.469867 0.337240 0.157117 N\n0.469867 0.132627 0.342883 N\n0.662760 0.530133 0.342883 N\n0.662760 0.132627 0.157117 N\n","nsites":46,"nelements":5,"elements":["Na","Mg","C","S","N"],"chemical_system":"C-Mg-N-Na-S","density":1.6540984709999145,"density_atomic":0.04929612460948217,"volume":933.1362326025896,"volume_molar":12.216255958671512,"formula_full":"Na8 Mg2 C12 S12 N12","formula_reduced":"Na4MgC6(SN)6","formula_anonymous":"AB4C6D6E6","energy":-299.89985888,"energy_per_atom":-6.519562149565218,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-289.53185888,"band_gap":4.2465,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0002694,"is_theoretical":false,"updated_at":"2021-11-28T01:37:12.498000Z","spacegroup":163},{"id":"mp-541819","created_at":"2022-09-04T14:45:55.277134Z","structure_string":"Rb4 Hg2 B18 Se18\n1.0\n9.974288 0.000000 0.000000\n-4.761786 9.639108 0.000000\n-0.124615 -2.284697 11.084736\nRb Hg B Se\n4 2 18 18\ndirect\n0.791542 0.174355 0.001590 Rb\n0.208458 0.825645 0.998410 Rb\n0.175505 0.344155 0.504242 Rb\n0.824495 0.655845 0.495758 Rb\n0.325260 0.318493 0.074700 Hg\n0.674740 0.681507 0.925300 Hg\n0.515708 0.163287 0.551780 B\n0.484292 0.836713 0.448220 B\n0.662111 0.120013 0.586389 B\n0.337889 0.879987 0.413611 B\n0.486065 0.042111 0.647951 B\n0.513935 0.957889 0.352049 B\n0.339070 0.008273 0.538580 B\n0.660930 0.991727 0.461420 B\n0.423541 0.064044 0.406341 B\n0.576459 0.935956 0.593659 B\n0.621218 0.132027 0.436149 B\n0.378782 0.867973 0.563851 B\n0.751159 0.414860 0.713996 B\n0.248841 0.585140 0.286004 B\n0.251382 0.086821 0.779549 B\n0.748618 0.913179 0.220451 B\n0.569964 0.284423 0.260696 B\n0.430036 0.715577 0.739304 B\n0.556392 0.362405 0.626819 Se\n0.443608 0.637595 0.373181 Se\n0.838893 0.279767 0.694249 Se\n0.161107 0.720233 0.305751 Se\n0.447349 0.094696 0.819328 Se\n0.552651 0.905304 0.180672 Se\n0.163350 0.028547 0.609554 Se\n0.836650 0.971453 0.390446 Se\n0.363249 0.157044 0.290129 Se\n0.636751 0.842956 0.709871 Se\n0.743956 0.287227 0.347927 Se\n0.256044 0.712773 0.652073 Se\n0.868914 0.601250 0.813924 Se\n0.131086 0.398750 0.186076 Se\n0.129910 0.121801 0.900960 Se\n0.870090 0.878199 0.099040 Se\n0.607965 0.406782 0.144532 Se\n0.392035 0.593218 0.855468 Se\n","nsites":42,"nelements":4,"elements":["Rb","Hg","B","Se"],"chemical_system":"B-Hg-Rb-Se","density":3.6755293863119607,"density_atomic":0.039409886666396075,"volume":1065.7224253276643,"volume_molar":15.280786800980438,"formula_full":"Rb4 Hg2 B18 Se18","formula_reduced":"Rb2Hg(BSe)9","formula_anonymous":"AB2C9D9","energy":-214.37444546,"energy_per_atom":-5.104153463333334,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-205.87844546,"band_gap":1.8297,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0003932,"is_theoretical":false,"updated_at":"2021-11-28T01:37:16.192000Z","spacegroup":2},{"id":"mp-645","created_at":"2022-09-04T14:45:55.355920Z","structure_string":"Tb1 P1\n1.0\n0.000000 2.849288 2.849288\n2.849288 0.000000 2.849288\n2.849288 2.849288 0.000000\nTb P\n1 1\ndirect\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 P\n","nsites":2,"nelements":2,"elements":["Tb","P"],"chemical_system":"P-Tb","density":6.816053469135878,"density_atomic":0.04323056911715061,"volume":46.263559348020515,"volume_molar":13.930283322619669,"formula_full":"Tb1 P1","formula_reduced":"TbP","formula_anonymous":"AB","energy":-13.26531921,"energy_per_atom":-6.632659605,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-13.26531921,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0018112,"is_theoretical":false,"updated_at":"2021-11-28T01:37:15.137000Z","spacegroup":225},{"id":"mp-720860","created_at":"2022-09-04T14:45:55.329953Z","structure_string":"H36 C4 S4 O28 F12\n1.0\n8.788622 0.000000 0.000000\n0.000000 7.711140 0.000000\n0.000000 0.393996 13.001138\nH C S O F\n36 4 4 28 12\ndirect\n0.865886 0.858017 0.951193 H\n0.365886 0.141983 0.548807 H\n0.134114 0.141983 0.048807 H\n0.634114 0.858017 0.451193 H\n0.865869 0.053094 0.883362 H\n0.365869 0.946906 0.616638 H\n0.134131 0.946906 0.116638 H\n0.634131 0.053094 0.383362 H\n0.799975 0.042982 0.008465 H\n0.299975 0.957018 0.491535 H\n0.200025 0.957018 0.991535 H\n0.700025 0.042982 0.508465 H\n0.923000 0.624800 0.906118 H\n0.423000 0.375200 0.593882 H\n0.077000 0.375200 0.093882 H\n0.577000 0.624800 0.406118 H\n0.870318 0.621335 0.022825 H\n0.370318 0.378665 0.477175 H\n0.129682 0.378665 0.977175 H\n0.629682 0.621335 0.522825 H\n0.915604 0.271392 0.788134 H\n0.415604 0.728608 0.711866 H\n0.084396 0.728608 0.211866 H\n0.584396 0.271392 0.288134 H\n0.046622 0.134150 0.781984 H\n0.546622 0.865850 0.718016 H\n0.953378 0.865850 0.218016 H\n0.453378 0.134150 0.281984 H\n0.716944 0.259971 0.611046 H\n0.216944 0.740029 0.888954 H\n0.283056 0.740029 0.388954 H\n0.783056 0.259971 0.111046 H\n0.789986 0.090018 0.659050 H\n0.289986 0.909982 0.840950 H\n0.210014 0.909982 0.340950 H\n0.710014 0.090018 0.159050 H\n0.007200 0.681130 0.621043 C\n0.507200 0.318870 0.878957 C\n0.992800 0.318870 0.378957 C\n0.492800 0.681130 0.121043 C\n0.834414 0.613433 0.695706 S\n0.334414 0.386567 0.804294 S\n0.165586 0.386567 0.304294 S\n0.665586 0.613433 0.195706 S\n0.748412 0.507123 0.623713 O\n0.248412 0.492877 0.876287 O\n0.251588 0.492877 0.376287 O\n0.751588 0.507123 0.123713 O\n0.897332 0.512994 0.783931 O\n0.397332 0.487006 0.716069 O\n0.102668 0.487006 0.216069 O\n0.602668 0.512994 0.283931 O\n0.763167 0.776539 0.721088 O\n0.263167 0.223461 0.778912 O\n0.236833 0.223461 0.278912 O\n0.736833 0.776539 0.221088 O\n0.811828 0.979545 0.939737 O\n0.311828 0.020455 0.560263 O\n0.188172 0.020455 0.060263 O\n0.688172 0.979545 0.439737 O\n0.932148 0.686705 0.971192 O\n0.432148 0.313295 0.528808 O\n0.067852 0.313295 0.028808 O\n0.567852 0.686705 0.471192 O\n0.934767 0.145075 0.786643 O\n0.434767 0.854925 0.713357 O\n0.065233 0.854925 0.213357 O\n0.565233 0.145075 0.286643 O\n0.712983 0.132474 0.609931 O\n0.212983 0.867526 0.890069 O\n0.287017 0.867526 0.390069 O\n0.787017 0.132474 0.109931 O\n0.089022 0.541237 0.593616 F\n0.589022 0.458763 0.906384 F\n0.910978 0.458763 0.406384 F\n0.410978 0.541237 0.093616 F\n0.097295 0.782730 0.678731 F\n0.597295 0.217270 0.821269 F\n0.902705 0.217270 0.321269 F\n0.402705 0.782730 0.178731 F\n0.966457 0.772928 0.534911 F\n0.466457 0.227072 0.965089 F\n0.033543 0.227072 0.465089 F\n0.533543 0.772928 0.034911 F\n","nsites":84,"nelements":5,"elements":["H","C","S","O","F"],"chemical_system":"C-F-H-O-S","density":1.674601731110292,"density_atomic":0.09533635512975296,"volume":881.0909530333506,"volume_molar":6.316730644677841,"formula_full":"H36 C4 S4 O28 F12","formula_reduced":"H9CSO7F3","formula_anonymous":"ABC3D7E9","energy":-459.5923527,"energy_per_atom":-5.471337532142857,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-434.8123527,"band_gap":5.8426,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.0007383,"is_theoretical":false,"updated_at":"2021-11-28T01:37:15.608000Z","spacegroup":14},{"id":"mp-568926","created_at":"2022-09-04T14:45:55.450299Z","structure_string":"Gd1 Sb1 Pt1\n1.0\n0.000000 3.373803 3.373803\n3.373803 0.000000 3.373803\n3.373803 3.373803 0.000000\nGd Sb Pt\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Gd\n0.250000 0.250000 0.250000 Sb\n0.500000 0.500000 0.500000 Pt\n","nsites":3,"nelements":3,"elements":["Gd","Sb","Pt"],"chemical_system":"Gd-Pt-Sb","density":10.25001263259349,"density_atomic":0.03905998739907341,"volume":76.8049402922021,"volume_molar":15.417672050101219,"formula_full":"Gd1 Sb1 Pt1","formula_reduced":"GdSbPt","formula_anonymous":"ABC","energy":-26.464117949999995,"energy_per_atom":-8.821372649999999,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-26.272117949999995,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":6.9964229,"is_theoretical":false,"updated_at":"2021-11-28T01:37:17.729000Z","spacegroup":216},{"id":"mp-9831","created_at":"2022-09-04T14:45:55.400257Z","structure_string":"La1 Ga1 O3\n1.0\n4.599907 0.000000 0.000000\n0.000000 4.599907 0.000000\n0.000000 0.000000 4.599907\nLa Ga O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n","nsites":5,"nelements":3,"elements":["La","Ga","O"],"chemical_system":"Ga-La-O","density":4.378282016363295,"density_atomic":0.05137157139323854,"volume":97.33009647935539,"volume_molar":11.722710823661172,"formula_full":"La1 Ga1 O3","formula_reduced":"LaGaO3","formula_anonymous":"ABC3","energy":-31.2413074,"energy_per_atom":-6.24826148,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-29.1803074,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0005082,"is_theoretical":false,"updated_at":"2021-11-28T01:37:11.803000Z","spacegroup":221},{"id":"mp-999267","created_at":"2022-09-04T14:45:55.402151Z","structure_string":"Rb1 Sn1 S2\n1.0\n7.790529 -2.041261 0.000000\n7.790529 2.041261 0.000000\n7.255681 0.000000 3.494879\nRb Sn S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Sn\n0.769393 0.769393 0.769393 S\n0.230607 0.230607 0.230607 S\n","nsites":4,"nelements":3,"elements":["Rb","Sn","S"],"chemical_system":"Rb-S-Sn","density":4.0082497048776675,"density_atomic":0.03598589967543759,"volume":111.15464768358218,"volume_molar":16.7347233619685,"formula_full":"Rb1 Sn1 S2","formula_reduced":"RbSnS2","formula_anonymous":"ABC2","energy":-16.93022468,"energy_per_atom":-4.23255617,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-15.92422468,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":0.2417552,"is_theoretical":false,"updated_at":"2021-11-28T01:37:09.809000Z","spacegroup":166},{"id":"mp-542120","created_at":"2022-09-04T14:45:55.342193Z","structure_string":"Ba8 Fe4 O16\n1.0\n6.219164 0.000000 -0.442691\n-0.000001 7.750420 -0.000014\n-0.038396 -0.000019 10.341097\nBa Fe O\n8 4 16\ndirect\n0.756271 0.845269 0.075079 Ba\n0.743729 0.345268 0.424922 Ba\n0.243727 0.154737 0.924922 Ba\n0.256272 0.654737 0.575078 Ba\n0.220211 0.505874 0.197397 Ba\n0.279790 0.005873 0.302605 Ba\n0.779787 0.494122 0.802606 Ba\n0.720213 0.994123 0.697392 Ba\n0.257440 0.721195 0.916809 Fe\n0.242563 0.221195 0.583190 Fe\n0.742543 0.278812 0.083193 Fe\n0.757455 0.778817 0.416807 Fe\n0.704791 0.007037 0.404261 O\n0.795209 0.507037 0.095739 O\n0.295212 0.992943 0.595742 O\n0.204787 0.492942 0.904258 O\n0.496966 0.244375 0.162975 O\n0.003034 0.744375 0.337026 O\n0.503048 0.755625 0.837018 O\n0.996952 0.255624 0.662980 O\n0.001388 0.183004 0.132260 O\n0.498612 0.683004 0.367742 O\n0.998595 0.817001 0.867735 O\n0.501406 0.317001 0.632264 O\n0.682461 0.168556 0.927459 O\n0.817539 0.668555 0.572540 O\n0.317542 0.831450 0.072548 O\n0.182457 0.331451 0.427453 O\n","nsites":28,"nelements":3,"elements":["Ba","Fe","O"],"chemical_system":"Ba-Fe-O","density":5.258274949070105,"density_atomic":0.05618869804281605,"volume":498.3208541095554,"volume_molar":10.717708311039882,"formula_full":"Ba8 Fe4 O16","formula_reduced":"Ba2FeO4","formula_anonymous":"AB2C4","energy":-195.3915957,"energy_per_atom":-6.978271275,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-175.3755957,"band_gap":0.0,"is_gap_direct":true,"is_magnetic":true,"total_magnetization":1.2e-06,"is_theoretical":false,"updated_at":"2021-11-28T01:37:15.442000Z","spacegroup":14},{"id":"mp-1078960","created_at":"2022-09-04T14:45:55.377457Z","structure_string":"As1 N1 F6\n1.0\n3.222478 -3.615443 0.000000\n3.222478 3.615443 0.000000\n-0.833849 0.000000 4.770795\nAs N F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 As\n0.500000 0.500000 0.500000 N\n0.773881 0.715873 0.085370 F\n0.085370 0.773881 0.715873 F\n0.715873 0.085370 0.773881 F\n0.226119 0.284127 0.914630 F\n0.914630 0.226119 0.284127 F\n0.284127 0.914630 0.226119 F\n","nsites":8,"nelements":3,"elements":["As","N","F"],"chemical_system":"As-F-N","density":3.0310910259936277,"density_atomic":0.07196440779117441,"volume":111.16606452476228,"volume_molar":8.368221103792012,"formula_full":"As1 N1 F6","formula_reduced":"AsNF6","formula_anonymous":"ABC6","energy":-34.03931818,"energy_per_atom":-4.2549147725,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-31.26731818,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":true,"total_magnetization":2.0,"is_theoretical":false,"updated_at":"2021-11-28T01:37:15.876000Z","spacegroup":148},{"id":"mp-15051","created_at":"2022-09-04T14:45:55.315951Z","structure_string":"Nd2 Pd4 O8\n1.0\n-2.970530 2.970530 5.137624\n2.970530 -2.970530 5.137624\n2.970530 2.970530 -5.137624\nNd Pd O\n2 4 8\ndirect\n0.500000 0.500000 0.000000 Nd\n0.250000 0.750000 0.500000 Nd\n0.875000 0.125000 0.750000 Pd\n0.875000 0.625000 0.750000 Pd\n0.875000 0.125000 0.250000 Pd\n0.375000 0.125000 0.250000 Pd\n0.500095 0.453065 0.351326 O\n0.203065 0.351739 0.452970 O\n0.898770 0.750095 0.547030 O\n0.101739 0.148770 0.648674 O\n0.249905 0.796935 0.148674 O\n0.546935 0.898261 0.047030 O\n0.648261 0.101230 0.851326 O\n0.851230 0.499905 0.952970 O\n","nsites":14,"nelements":3,"elements":["Nd","Pd","O"],"chemical_system":"Nd-O-Pd","density":7.711752820594374,"density_atomic":0.07720365153191183,"volume":181.33857301054152,"volume_molar":7.8003315134787,"formula_full":"Nd2 Pd4 O8","formula_reduced":"Nd(PdO2)2","formula_anonymous":"AB2C4","energy":-97.08669583,"energy_per_atom":-6.934763987857143,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-91.59069583,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":1.1405257,"is_theoretical":false,"updated_at":"2021-11-28T01:37:15.222000Z","spacegroup":88},{"id":"mp-749","created_at":"2022-09-04T14:45:56.012886Z","structure_string":"Sm1 N1\n1.0\n0.000000 2.537114 2.537114\n2.537114 0.000000 2.537114\n2.537114 2.537114 0.000000\nSm N\n1 1\ndirect\n0.500000 0.500000 0.500000 Sm\n0.000000 0.000000 0.000000 N\n","nsites":2,"nelements":2,"elements":["Sm","N"],"chemical_system":"N-Sm","density":8.35628016436124,"density_atomic":0.06123222696223721,"volume":32.66253898022407,"volume_molar":9.83492036589481,"formula_full":"Sm1 N1","formula_reduced":"SmN","formula_anonymous":"AB","energy":-16.369161560000002,"energy_per_atom":-8.184580780000001,"energy_above_hull":null,"is_stable":null,"decomposes_to":null,"formation_energy":null,"formation_energy_per_atom":null,"energy_uncorrected":-16.00816156,"band_gap":0.0,"is_gap_direct":false,"is_magnetic":false,"total_magnetization":9.6e-06,"is_theoretical":false,"updated_at":"2021-11-28T01:37:08.075000Z","spacegroup":225}]}