{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume&page=3593","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume&page=3591","results":[{"id":"jvasp-106344","created_at":"2022-09-04T14:38:17.425719Z","updated_at":"2022-09-04T14:38:17.425728Z","structure_string":"Nb3 Au1\n1.0\n2.819169 -0.012648 0.000000\n-0.653576 2.742392 0.000000\n0.000000 0.000000 9.344631\nNb Au\n3 1\ndirect\n0.499999 0.499999 0.751450 Nb\n0.000000 0.000000 0.500000 Nb\n0.499999 0.499999 0.248550 Nb\n0.000000 0.000000 0.000000 Au\n","nsites":4,"nelements":2,"elements":["Nb","Au"],"chemical_system":"Au-Nb","density":10.945132045992223,"density_atomic":0.055425777645575755,"volume":72.16858598860438,"volume_molar":10.865234581838484,"formula_full":"Nb3 Au1","formula_reduced":"Nb3Au","formula_anonymous":"AB3","energy_above_hull":4.1973264425,"spacegroup":65},{"id":"jvasp-41891","created_at":"2022-09-04T14:37:34.663541Z","updated_at":"2022-09-04T14:37:34.663562Z","structure_string":"Sc2 Ag1 Ir1\n1.0\n-0.000001 3.304390 3.304389\n3.304400 0.000003 3.304387\n3.304405 3.304393 -0.000003\nSc Ag Ir\n2 1 1\ndirect\n0.500000 0.500001 0.500000 Sc\n0.000000 0.000001 0.000000 Sc\n0.250000 0.250001 0.250000 Ag\n0.750001 0.750003 0.750000 Ir\n","nsites":4,"nelements":3,"elements":["Sc","Ag","Ir"],"chemical_system":"Ag-Ir-Sc","density":8.974388256313887,"density_atomic":0.05543122229885527,"volume":72.16149733148868,"volume_molar":10.86416735956473,"formula_full":"Sc2 Ag1 Ir1","formula_reduced":"Sc2AgIr","formula_anonymous":"ABC2","energy_above_hull":2.201057215,"spacegroup":225},{"id":"jvasp-71023","created_at":"2022-09-04T14:36:14.715767Z","updated_at":"2022-09-04T14:36:14.715791Z","structure_string":"Li1 Sc2 Be1\n1.0\n3.280153 0.000000 0.000000\n-0.000000 3.280153 -0.000000\n-0.000000 -0.000000 6.706657\nLi Sc Be\n1 2 1\ndirect\n0.500000 0.500000 0.702373 Li\n0.000000 0.000000 0.980996 Sc\n0.500000 0.500000 0.296696 Sc\n0.000000 0.000000 0.519936 Be\n","nsites":4,"nelements":3,"elements":["Li","Sc","Be"],"chemical_system":"Be-Li-Sc","density":2.4361679494619364,"density_atomic":0.05543265661074186,"volume":72.15963016329388,"volume_molar":10.86388625082244,"formula_full":"Li1 Sc2 Be1","formula_reduced":"LiSc2Be","formula_anonymous":"ABC2","energy_above_hull":1.97452915,"spacegroup":99},{"id":"jvasp-115611","created_at":"2022-09-04T14:38:45.120978Z","updated_at":"2022-09-04T14:38:45.121011Z","structure_string":"Be1 Cd1 Br1\n1.0\n5.520862 0.000000 -0.000000\n-2.760431 4.781206 -0.000000\n-0.000000 -0.000000 2.733568\nBe Cd Br\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.666667 0.333333 0.000000 Cd\n0.333334 0.666667 0.000000 Br\n","nsites":3,"nelements":3,"elements":["Be","Cd","Br"],"chemical_system":"Be-Br-Cd","density":4.6331598362722834,"density_atomic":0.04157641372130131,"volume":72.1562956369894,"volume_molar":14.484512301537467,"formula_full":"Be1 Cd1 Br1","formula_reduced":"BeCdBr","formula_anonymous":"ABC","energy_above_hull":0.4561633674999998,"spacegroup":187},{"id":"jvasp-49974","created_at":"2022-09-04T14:38:15.372940Z","updated_at":"2022-09-04T14:38:15.372953Z","structure_string":"Sm1 Tl1 O2\n1.0\n3.597779 0.000000 0.000000\n-1.798890 1.038589 6.436441\n1.798890 -3.115768 0.000000\nSm Tl O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Sm\n0.000000 0.000000 0.000000 Tl\n0.225992 0.677975 0.225992 O\n0.774008 0.322025 0.774009 O\n","nsites":4,"nelements":3,"elements":["Sm","Tl","O"],"chemical_system":"O-Sm-Tl","density":8.900720443236278,"density_atomic":0.05543889986955333,"volume":72.15150389729817,"volume_molar":10.862662812880455,"formula_full":"Sm1 Tl1 O2","formula_reduced":"SmTlO2","formula_anonymous":"ABC2","energy_above_hull":0.8061746187500001,"spacegroup":166},{"id":"jvasp-115285","created_at":"2022-09-04T14:38:46.071391Z","updated_at":"2022-09-04T14:38:46.071416Z","structure_string":"Te1 Pb1 O2\n1.0\n3.611352 -0.000000 -0.000000\n0.000000 3.611352 -0.000000\n-0.000000 0.000000 5.532043\nTe Pb O\n1 1 2\ndirect\n0.499999 0.499999 0.522510 Te\n0.000000 0.000000 0.012848 Pb\n0.000000 0.000000 0.583586 O\n0.499999 0.499999 0.891054 O\n","nsites":4,"nelements":3,"elements":["Te","Pb","O"],"chemical_system":"O-Pb-Te","density":8.442125688668227,"density_atomic":0.05544147824730191,"volume":72.14814839816545,"volume_molar":10.862157630678022,"formula_full":"Te1 Pb1 O2","formula_reduced":"TePbO2","formula_anonymous":"ABC2","energy_above_hull":1.3347313966666667,"spacegroup":99},{"id":"jvasp-8827","created_at":"2022-09-04T14:36:49.687433Z","updated_at":"2022-09-04T14:36:49.687456Z","structure_string":"Li3 Ta1 O4\n1.0\n5.821274 -0.000000 0.000000\n5.821274 5.157194 0.081864\n2.910637 3.476739 2.458353\nLi Ta O\n3 1 4\ndirect\n0.500000 0.000000 0.000000 Li\n0.249997 0.500000 -0.000001 Li\n0.750002 0.500000 -0.000001 Li\n0.000000 0.000000 0.000000 Ta\n0.500000 0.500001 0.499998 O\n0.227516 0.000021 0.544928 O\n-0.000000 0.500001 0.499998 O\n0.772484 -0.000020 0.455071 O\n","nsites":8,"nelements":3,"elements":["Li","Ta","O"],"chemical_system":"Li-O-Ta","density":6.1169880018922305,"density_atomic":0.1108855731495514,"volume":72.1464458609994,"volume_molar":5.430950653858222,"formula_full":"Li3 Ta1 O4","formula_reduced":"Li3TaO4","formula_anonymous":"AB3C4","energy_above_hull":2.3520929,"spacegroup":139},{"id":"jvasp-15259","created_at":"2022-09-04T14:37:03.682940Z","updated_at":"2022-09-04T14:37:03.682965Z","structure_string":"Lu1 B1 Rh3\n1.0\n4.162950 -0.000000 -0.000000\n0.000000 4.162950 -0.000000\n0.000000 0.000000 4.162950\nLu B Rh\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 B\n0.000000 0.500000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n0.500000 0.000000 0.500000 Rh\n","nsites":5,"nelements":3,"elements":["Lu","B","Rh"],"chemical_system":"B-Lu-Rh","density":11.381695926280713,"density_atomic":0.0693052955889982,"volume":72.1445591928724,"volume_molar":8.689293810552593,"formula_full":"Lu1 B1 Rh3","formula_reduced":"LuBRh3","formula_anonymous":"ABC3","energy_above_hull":2.9211154666666665,"spacegroup":221},{"id":"jvasp-70842","created_at":"2022-09-04T14:36:09.985474Z","updated_at":"2022-09-04T14:36:09.985500Z","structure_string":"Li1 Sc2 Be1\n1.0\n3.282111 0.000000 0.000000\n0.000000 3.282111 0.000000\n-0.000000 0.000000 6.697244\nLi Sc Be\n1 2 1\ndirect\n0.500000 0.500000 0.702648 Li\n0.000000 0.000000 0.981080 Sc\n0.500000 0.500000 0.296610 Sc\n0.000000 0.000000 0.519661 Be\n","nsites":4,"nelements":3,"elements":["Li","Sc","Be"],"chemical_system":"Be-Li-Sc","density":2.436682098846209,"density_atomic":0.05544435558505571,"volume":72.14440420114012,"volume_molar":10.86159392864003,"formula_full":"Li1 Sc2 Be1","formula_reduced":"LiSc2Be","formula_anonymous":"ABC2","energy_above_hull":1.97438665,"spacegroup":99},{"id":"jvasp-7829","created_at":"2022-09-04T14:37:07.121765Z","updated_at":"2022-09-04T14:37:07.121785Z","structure_string":"Dy1 Sb1 Pt1\n1.0\n4.046652 -0.000000 2.336336\n1.348884 3.815221 2.336336\n0.000000 -0.000000 4.672672\nDy Sb Pt\n1 1 1\ndirect\n0.499999 0.500000 0.500001 Dy\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250001 Pt\n","nsites":3,"nelements":3,"elements":["Dy","Sb","Pt"],"chemical_system":"Dy-Pt-Sb","density":11.03355688956417,"density_atomic":0.04158535375140947,"volume":72.14078345788558,"volume_molar":14.481398417335548,"formula_full":"Dy1 Sb1 Pt1","formula_reduced":"DySbPt","formula_anonymous":"ABC","energy_above_hull":1.263238,"spacegroup":216},{"id":"jvasp-105973","created_at":"2022-09-04T14:36:12.279579Z","updated_at":"2022-09-04T14:36:12.279597Z","structure_string":"U2 C1 S1\n1.0\n3.533820 0.022186 5.594143\n1.635599 3.132601 5.594143\n0.036355 0.022186 6.616721\nU C S\n2 1 1\ndirect\n0.261717 0.261718 0.261717 U\n0.738282 0.738284 0.738282 U\n0.000000 0.000000 0.000000 C\n0.499999 0.500001 0.499999 S\n","nsites":4,"nelements":3,"elements":["U","C","S"],"chemical_system":"C-S-U","density":11.972723622616709,"density_atomic":0.05544839868108608,"volume":72.13914369297078,"volume_molar":10.860801940623407,"formula_full":"U2 C1 S1","formula_reduced":"U2CS","formula_anonymous":"ABC2","energy_above_hull":4.742903,"spacegroup":166},{"id":"jvasp-118028","created_at":"2022-09-04T14:38:30.636814Z","updated_at":"2022-09-04T14:38:30.636839Z","structure_string":"H1 N1 Cl1\n1.0\n3.505512 1.116637 0.000000\n1.953301 6.224372 0.000000\n0.000000 0.000000 3.673344\nH N Cl\n1 1 1\ndirect\n0.138213 -0.002562 0.000000 H\n0.037485 0.359589 0.000000 N\n0.024076 -0.157129 0.000000 Cl\n","nsites":3,"nelements":3,"elements":["H","N","Cl"],"chemical_system":"Cl-H-N","density":1.1616961911014112,"density_atomic":0.04158643827363152,"volume":72.13890211661126,"volume_molar":14.481020760603165,"formula_full":"H1 N1 Cl1","formula_reduced":"HNCl","formula_anonymous":"ABC","energy_above_hull":2.806002439166666,"spacegroup":6}]}