{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_full&page=4413","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_full&page=4411","results":[{"id":"jvasp-66549","created_at":"2022-09-04T14:36:10.911273Z","updated_at":"2022-09-04T14:36:10.911302Z","structure_string":"Ba1 Mg1 Tl1\n1.0\n0.000000 3.985469 3.985469\n3.985469 -0.000000 3.985469\n3.985469 3.985469 0.000000\nBa Mg Tl\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Tl\n","nsites":3,"nelements":3,"elements":["Ba","Mg","Tl"],"chemical_system":"Ba-Mg-Tl","density":4.80042883157788,"density_atomic":0.023694794842276767,"volume":126.61008546262384,"volume_molar":25.415458543051685,"formula_full":"Ba1 Mg1 Tl1","formula_reduced":"BaMgTl","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-58136","created_at":"2022-09-04T14:37:02.684825Z","updated_at":"2022-09-04T14:37:02.684852Z","structure_string":"Ba1 Mg1 Ti4 O8\n1.0\n2.720922 -4.712775 -0.000000\n2.720922 4.712775 -0.000000\n0.000000 0.000000 7.303613\nBa Mg Ti O\n1 1 4 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Mg\n0.333333 0.666667 0.740933 Ti\n0.666667 0.333333 0.740933 Ti\n0.333333 0.666667 0.259067 Ti\n0.666667 0.333333 0.259067 Ti\n0.312645 0.312645 0.674418 O\n0.687354 0.000000 0.674418 O\n0.000000 0.687354 0.674418 O\n0.687354 0.687354 0.325582 O\n0.000000 0.312645 0.325582 O\n0.312645 0.000000 0.325582 O\n0.333333 0.666667 0.000000 O\n0.666667 0.333333 0.000000 O\n","nsites":14,"nelements":4,"elements":["Ba","Mg","Ti","O"],"chemical_system":"Ba-Mg-O-Ti","density":4.2650052945461185,"density_atomic":0.0747424774320949,"volume":187.3098200781382,"volume_molar":8.057186444577301,"formula_full":"Ba1 Mg1 Ti4 O8","formula_reduced":"BaMgTi4O8","formula_anonymous":"ABC4D8","energy_above_hull":2.749707596666666,"spacegroup":162},{"id":"jvasp-117607","created_at":"2022-09-04T14:38:52.806081Z","updated_at":"2022-09-04T14:38:52.806101Z","structure_string":"Ba1 Mg1 Te2\n1.0\n4.653835 0.000000 -0.000000\n0.000000 4.653835 0.000000\n0.000000 0.000000 7.049883\nBa Mg Te\n1 1 2\ndirect\n0.499999 0.499999 0.515483 Ba\n0.000000 0.000000 0.049731 Mg\n0.000000 0.000000 0.443278 Te\n0.499999 0.499999 0.001508 Te\n","nsites":4,"nelements":3,"elements":["Ba","Mg","Te"],"chemical_system":"Ba-Mg-Te","density":4.5332145829515795,"density_atomic":0.026197274991606484,"volume":152.687636453852,"volume_molar":22.9876609759201,"formula_full":"Ba1 Mg1 Te2","formula_reduced":"BaMgTe2","formula_anonymous":"ABC2","energy_above_hull":0.0897994416666666,"spacegroup":99},{"id":"jvasp-117605","created_at":"2022-09-04T14:38:46.471337Z","updated_at":"2022-09-04T14:38:46.471364Z","structure_string":"Ba1 Mg1 Te1\n1.0\n5.957290 0.000000 -0.000000\n-2.978645 5.159164 0.000000\n-0.000000 0.000000 4.506154\nBa Mg Te\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333334 0.666666 0.000000 Mg\n0.666666 0.333333 0.000000 Te\n","nsites":3,"nelements":3,"elements":["Ba","Mg","Te"],"chemical_system":"Ba-Mg-Te","density":3.467858214602035,"density_atomic":0.021661431284857258,"volume":138.49500342561362,"volume_molar":27.801213506190912,"formula_full":"Ba1 Mg1 Te1","formula_reduced":"BaMgTe","formula_anonymous":"ABC","energy_above_hull":0.1168766666666666,"spacegroup":187},{"id":"jvasp-117606","created_at":"2022-09-04T14:38:46.483220Z","updated_at":"2022-09-04T14:38:46.483252Z","structure_string":"Ba1 Mg1 Te1\n1.0\n3.595406 0.000000 0.000000\n0.000000 3.595406 -0.000000\n-0.000000 0.000000 9.610380\nBa Mg Te\n1 1 1\ndirect\n0.000000 0.000000 0.336127 Ba\n0.000000 0.000000 0.702781 Mg\n0.000000 0.000000 -0.006658 Te\n","nsites":3,"nelements":3,"elements":["Ba","Mg","Te"],"chemical_system":"Ba-Mg-Te","density":3.8659746345402977,"density_atomic":0.024148202928967195,"volume":124.23284700830979,"volume_molar":24.938256389986215,"formula_full":"Ba1 Mg1 Te1","formula_reduced":"BaMgTe","formula_anonymous":"ABC","energy_above_hull":0.2368766666666666,"spacegroup":99},{"id":"jvasp-117604","created_at":"2022-09-04T14:38:51.455124Z","updated_at":"2022-09-04T14:38:51.455143Z","structure_string":"Ba1 Mg1 Te1\n1.0\n7.197385 -1.335350 0.000000\n-0.607501 4.537647 0.000000\n0.000000 0.000000 4.497792\nBa Mg Te\n1 1 1\ndirect\n-0.194322 -0.204127 0.000000 Ba\n0.403482 0.094613 0.000000 Mg\n0.164878 0.475468 0.000000 Te\n","nsites":3,"nelements":3,"elements":["Ba","Mg","Te"],"chemical_system":"Ba-Mg-Te","density":3.3528518936305045,"density_atomic":0.020943062376763095,"volume":143.2455266584405,"volume_molar":28.754824159248702,"formula_full":"Ba1 Mg1 Te1","formula_reduced":"BaMgTe","formula_anonymous":"ABC","energy_above_hull":0.0501166666666666,"spacegroup":38},{"id":"jvasp-66505","created_at":"2022-09-04T14:36:09.619904Z","updated_at":"2022-09-04T14:36:09.619936Z","structure_string":"Ba1 Mg1 Te1\n1.0\n-0.000000 4.041344 4.041344\n4.041344 0.000000 4.041344\n4.041344 4.041344 0.000000\nBa Mg Te\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Mg\n0.499999 0.499999 0.499999 Te\n","nsites":3,"nelements":3,"elements":["Ba","Mg","Te"],"chemical_system":"Ba-Mg-Te","density":3.6382118556168597,"density_atomic":0.022725518528513886,"volume":132.01018917284006,"volume_molar":26.49946469843569,"formula_full":"Ba1 Mg1 Te1","formula_reduced":"BaMgTe","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-9293","created_at":"2022-09-04T14:38:34.773115Z","updated_at":"2022-09-04T14:38:34.773133Z","structure_string":"Ba1 Mg1 Sn4 O8\n1.0\n2.978548 -5.158995 0.000000\n2.978548 5.158995 0.000000\n-0.000000 -0.000000 6.934111\nBa Mg Sn O\n1 1 4 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Mg\n0.333333 0.666668 0.708186 Sn\n0.666668 0.333333 0.708186 Sn\n0.333333 0.666668 0.291814 Sn\n0.666668 0.333333 0.291814 Sn\n0.287700 0.287700 0.693623 O\n0.712301 -0.000000 0.693623 O\n-0.000000 0.712301 0.693623 O\n0.712301 0.712301 0.306377 O\n-0.000000 0.287700 0.306377 O\n0.287700 -0.000000 0.306377 O\n0.333333 0.666668 0.000000 O\n0.666668 0.333333 0.000000 O\n","nsites":14,"nelements":4,"elements":["Ba","Mg","Sn","O"],"chemical_system":"Ba-Mg-O-Sn","density":5.956860894995605,"density_atomic":0.06569579013163693,"volume":213.1034571918188,"volume_molar":9.166707254655478,"formula_full":"Ba1 Mg1 Sn4 O8","formula_reduced":"BaMg(SnO2)4","formula_anonymous":"ABC4D8","energy_above_hull":1.6207585585714284,"spacegroup":162},{"id":"jvasp-66413","created_at":"2022-09-04T14:35:46.261530Z","updated_at":"2022-09-04T14:35:46.261561Z","structure_string":"Ba1 Mg1 Sn1\n1.0\n0.000000 3.936334 3.936334\n3.936334 0.000000 3.936334\n3.936334 3.936334 -0.000000\nBa Mg Sn\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Sn\n","nsites":3,"nelements":3,"elements":["Ba","Mg","Sn"],"chemical_system":"Ba-Mg-Sn","density":3.8162027910068925,"density_atomic":0.024593222261477442,"volume":121.98482850696502,"volume_molar":24.486993595113464,"formula_full":"Ba1 Mg1 Sn1","formula_reduced":"BaMgSn","formula_anonymous":"ABC","energy_above_hull":0.0710333333333333,"spacegroup":216},{"id":"jvasp-69241","created_at":"2022-09-04T14:35:43.722889Z","updated_at":"2022-09-04T14:35:43.722924Z","structure_string":"Ba1 Mg1 Se4\n1.0\n-0.000000 4.285916 4.285916\n4.285916 -0.000000 4.285916\n4.285916 4.285916 0.000000\nBa Mg Se\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Mg\n0.119843 0.626719 0.626719 Se\n0.626719 0.626719 0.626719 Se\n0.626719 0.119843 0.626719 Se\n0.626719 0.626719 0.119843 Se\n","nsites":6,"nelements":3,"elements":["Ba","Mg","Se"],"chemical_system":"Ba-Mg-Se","density":5.035423999077776,"density_atomic":0.03810573032874114,"volume":157.45663311626694,"volume_molar":15.803766803697282,"formula_full":"Ba1 Mg1 Se4","formula_reduced":"BaMgSe4","formula_anonymous":"ABC4","energy_above_hull":0.7880466833333329,"spacegroup":216},{"id":"jvasp-117603","created_at":"2022-09-04T14:38:52.094076Z","updated_at":"2022-09-04T14:38:52.094096Z","structure_string":"Ba1 Mg1 Se2\n1.0\n4.325514 0.000000 0.000000\n0.000000 4.325514 0.000000\n-0.000000 0.000000 6.713278\nBa Mg Se\n1 1 2\ndirect\n0.500000 0.500000 0.521913 Ba\n0.000000 0.000000 0.054220 Mg\n0.000000 0.000000 0.431375 Se\n0.500000 0.500000 0.002493 Se\n","nsites":4,"nelements":3,"elements":["Ba","Mg","Se"],"chemical_system":"Ba-Mg-Se","density":4.224551040905603,"density_atomic":0.031845635170400906,"volume":125.605910467687,"volume_molar":18.910411828109215,"formula_full":"Ba1 Mg1 Se2","formula_reduced":"BaMgSe2","formula_anonymous":"ABC2","energy_above_hull":0.0779333416666666,"spacegroup":99},{"id":"jvasp-117602","created_at":"2022-09-04T14:38:36.075869Z","updated_at":"2022-09-04T14:38:36.075895Z","structure_string":"Ba1 Mg1 Se2\n1.0\n-0.000000 3.763085 3.763085\n3.763085 -0.000000 3.763085\n3.763085 3.763085 0.000000\nBa Mg Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Mg\n0.750000 0.750000 0.750000 Se\n0.250000 0.250000 0.250000 Se\n","nsites":4,"nelements":3,"elements":["Ba","Mg","Se"],"chemical_system":"Ba-Mg-Se","density":4.978844438934503,"density_atomic":0.03753167189536399,"volume":106.57665374331727,"volume_molar":16.045490264300938,"formula_full":"Ba1 Mg1 Se2","formula_reduced":"BaMgSe2","formula_anonymous":"ABC2","energy_above_hull":0.1287333416666666,"spacegroup":225}]}