{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-energy_above_hull&page=4613","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-energy_above_hull&page=4611","results":[{"id":"jvasp-91889","created_at":"2022-09-04T14:36:06.185272Z","updated_at":"2022-09-04T14:36:06.185286Z","structure_string":"Mg7 Co1\n1.0\n6.168845 0.000000 -0.000000\n-3.084422 5.342376 0.000000\n-0.000000 0.000000 4.848621\nMg Co\n7 1\ndirect\n0.166956 0.833478 0.250000 Mg\n0.666523 0.333045 0.250000 Mg\n0.666524 0.833478 0.250000 Mg\n0.323333 0.176668 0.750000 Mg\n0.323333 0.646665 0.750000 Mg\n0.853337 0.176668 0.750000 Mg\n0.833334 0.666668 0.750000 Mg\n0.166667 0.333333 0.250000 Co\n","nsites":8,"nelements":2,"elements":["Mg","Co"],"chemical_system":"Co-Mg","density":2.380440574312187,"density_atomic":0.05006491002132258,"volume":159.79255723405495,"volume_molar":12.028665900797941,"formula_full":"Mg7 Co1","formula_reduced":"Mg7Co","formula_anonymous":"AB7","energy_above_hull":0.0,"spacegroup":187},{"id":"jvasp-65685","created_at":"2022-09-04T14:36:06.203567Z","updated_at":"2022-09-04T14:36:06.203582Z","structure_string":"Ba2 Li1 Zn1\n1.0\n-0.000000 4.171108 4.171108\n4.171108 -0.000000 4.171108\n4.171108 4.171108 -0.000000\nBa Li Zn\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Zn\n","nsites":4,"nelements":3,"elements":["Ba","Li","Zn"],"chemical_system":"Ba-Li-Zn","density":3.9700801817657045,"density_atomic":0.02755977647674573,"volume":145.1390581260738,"volume_molar":21.851195945225953,"formula_full":"Ba2 Li1 Zn1","formula_reduced":"Ba2LiZn","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-86811","created_at":"2022-09-04T14:35:55.637585Z","updated_at":"2022-09-04T14:35:55.637617Z","structure_string":"Yb4 Cd2 Sb4\n1.0\n4.476422 -0.000000 -1.186928\n0.000000 7.146663 0.000000\n-0.011350 0.000000 8.991926\nYb Cd Sb\n4 2 4\ndirect\n0.479539 0.718562 0.959080 Yb\n0.520460 0.218563 0.040921 Yb\n0.697429 0.533748 0.394858 Yb\n0.302571 0.033748 0.605142 Yb\n0.901971 0.396199 0.803944 Cd\n0.098029 0.896199 0.196057 Cd\n0.319931 0.514608 0.639863 Sb\n0.680068 0.014608 0.360137 Sb\n0.069373 0.494392 0.138747 Sb\n0.930626 0.994392 0.861253 Sb\n","nsites":10,"nelements":3,"elements":["Yb","Cd","Sb"],"chemical_system":"Cd-Sb-Yb","density":8.107395088701784,"density_atomic":0.03477429444692983,"volume":287.5687388930729,"volume_molar":17.317794237897715,"formula_full":"Yb4 Cd2 Sb4","formula_reduced":"Yb2CdSb2","formula_anonymous":"AB2C2","energy_above_hull":0.0,"spacegroup":36},{"id":"jvasp-98569","created_at":"2022-09-04T14:35:58.364438Z","updated_at":"2022-09-04T14:35:58.364464Z","structure_string":"Mg10 Tl4\n1.0\n5.777345 -0.000226 -2.228512\n-1.212274 6.560206 -3.138153\n0.007768 -0.017831 8.613445\nMg Tl\n10 4\ndirect\n0.413826 0.075542 0.827894 Mg\n0.482628 0.732567 0.465024 Mg\n0.249982 0.500027 0.000021 Mg\n0.086073 0.247700 0.172090 Mg\n0.586175 0.924458 0.172106 Mg\n0.517372 0.267433 0.534976 Mg\n0.017396 0.267555 0.534919 Mg\n0.982604 0.732445 0.465082 Mg\n0.913927 0.752300 0.827910 Mg\n0.750018 0.499973 -0.000020 Mg\n0.622335 0.354148 0.244715 Tl\n0.877595 0.109378 0.755210 Tl\n0.122405 0.890622 0.244790 Tl\n0.377665 0.645853 0.755285 Tl\n","nsites":14,"nelements":2,"elements":["Mg","Tl"],"chemical_system":"Mg-Tl","density":5.399052155425007,"density_atomic":0.04291920981446966,"volume":326.19426267442793,"volume_molar":14.031341178070136,"formula_full":"Mg10 Tl4","formula_reduced":"Mg5Tl2","formula_anonymous":"A2B5","energy_above_hull":0.0,"spacegroup":72},{"id":"jvasp-91757","created_at":"2022-09-04T14:35:53.123012Z","updated_at":"2022-09-04T14:35:53.123037Z","structure_string":"Sr2 Ag2 S2 F2\n1.0\n4.082825 0.000000 0.000000\n-0.000000 4.082825 -0.000000\n0.000000 0.000000 9.076110\nSr Ag S F\n2 2 2 2\ndirect\n0.749999 0.749999 0.843013 Sr\n0.250000 0.250000 0.156987 Sr\n0.250000 0.749999 0.500000 Ag\n0.749999 0.250000 0.500000 Ag\n0.749999 0.749999 0.304283 S\n0.250000 0.250000 0.695717 S\n0.250000 0.749999 0.000000 F\n0.749999 0.250000 0.000000 F\n","nsites":8,"nelements":4,"elements":["Sr","Ag","S","F"],"chemical_system":"Ag-F-S-Sr","density":5.412097880845368,"density_atomic":0.05287723110877221,"volume":151.29385242475033,"volume_molar":11.388910942806424,"formula_full":"Sr2 Ag2 S2 F2","formula_reduced":"SrAgSF","formula_anonymous":"ABCD","energy_above_hull":0.0,"spacegroup":129},{"id":"jvasp-93892","created_at":"2022-09-04T14:36:02.890369Z","updated_at":"2022-09-04T14:36:02.890396Z","structure_string":"Nd1 Cu4 Ag1\n1.0\n-3.631585 -3.631585 -0.000000\n-3.631585 -0.000000 -3.631585\n0.000000 -3.631585 -3.631585\nNd Cu Ag\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.869670 0.376778 0.376778 Cu\n0.376778 0.869670 0.376778 Cu\n0.376778 0.376778 0.869670 Cu\n0.376778 0.376778 0.376778 Cu\n0.750001 0.750001 0.750001 Ag\n","nsites":6,"nelements":3,"elements":["Nd","Cu","Ag"],"chemical_system":"Ag-Cu-Nd","density":8.77674363952103,"density_atomic":0.06263724012231918,"volume":95.78966104322424,"volume_molar":9.614313702583079,"formula_full":"Nd1 Cu4 Ag1","formula_reduced":"NdCu4Ag","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-105871","created_at":"2022-09-04T14:36:06.098434Z","updated_at":"2022-09-04T14:36:06.098456Z","structure_string":"Yb1 Lu1 Hg2\n1.0\n4.466994 0.000000 2.579020\n1.488998 4.211522 2.579020\n0.000000 0.000000 5.158041\nYb Lu Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Lu\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n","nsites":4,"nelements":3,"elements":["Yb","Lu","Hg"],"chemical_system":"Hg-Lu-Yb","density":12.820356371088186,"density_atomic":0.041221212160241216,"volume":97.03741812469283,"volume_molar":14.609324773346886,"formula_full":"Yb1 Lu1 Hg2","formula_reduced":"YbLuHg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-116008","created_at":"2022-09-04T14:38:40.491638Z","updated_at":"2022-09-04T14:38:40.491660Z","structure_string":"La2 O2 F2\n1.0\n4.077081 0.000000 0.000000\n0.000000 4.077081 0.000000\n-0.000000 0.000000 5.826846\nLa O F\n2 2 2\ndirect\n0.500000 0.000000 0.715901 La\n0.000000 0.500000 0.284100 La\n0.000000 0.000000 0.500001 O\n0.500000 0.500000 0.500001 O\n0.500000 0.500000 0.000000 F\n0.000000 0.000000 0.000000 F\n","nsites":6,"nelements":3,"elements":["La","O","F"],"chemical_system":"F-La-O","density":5.962860234791878,"density_atomic":0.06194682196217475,"volume":96.85726902444891,"volume_molar":9.721468461573654,"formula_full":"La2 O2 F2","formula_reduced":"LaOF","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":129},{"id":"jvasp-110679","created_at":"2022-09-04T14:38:39.236579Z","updated_at":"2022-09-04T14:38:39.236601Z","structure_string":"Rb2 Nd1 Cu1 Br6\n1.0\n6.752430 -0.000000 3.898517\n2.250810 6.366252 3.898517\n-0.000000 -0.000000 7.797035\nRb Nd Cu Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Cu\n0.759572 0.240428 0.240429 Br\n0.240429 0.240428 0.759571 Br\n0.240429 0.759571 0.759571 Br\n0.240429 0.759571 0.240429 Br\n0.759572 0.240428 0.759571 Br\n0.759572 0.759571 0.240429 Br\n","nsites":10,"nelements":4,"elements":["Rb","Nd","Cu","Br"],"chemical_system":"Br-Cu-Nd-Rb","density":4.2514560086490505,"density_atomic":0.029835038317278018,"volume":335.17637529591565,"volume_molar":20.18479311458591,"formula_full":"Rb2 Nd1 Cu1 Br6","formula_reduced":"Rb2NdCuBr6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-105003","created_at":"2022-09-04T14:38:45.385016Z","updated_at":"2022-09-04T14:38:45.385041Z","structure_string":"K3 Tm1 Cl6\n1.0\n6.698045 -0.000000 3.867118\n2.232682 6.314978 3.867118\n-0.000000 -0.000000 7.734237\nK Tm Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Tm\n0.764383 0.235618 0.235617 Cl\n0.235617 0.235618 0.764383 Cl\n0.235617 0.764383 0.764383 Cl\n0.235617 0.764383 0.235618 Cl\n0.764383 0.235618 0.764383 Cl\n0.764383 0.764383 0.235618 Cl\n","nsites":10,"nelements":3,"elements":["K","Tm","Cl"],"chemical_system":"Cl-K-Tm","density":2.5325978276821335,"density_atomic":0.030567690054448215,"volume":327.1428093581052,"volume_molar":19.70100046576355,"formula_full":"K3 Tm1 Cl6","formula_reduced":"K3TmCl6","formula_anonymous":"AB3C6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-110753","created_at":"2022-09-04T14:38:45.378810Z","updated_at":"2022-09-04T14:38:45.378830Z","structure_string":"Ca2 Zn1 Pb1\n1.0\n4.638107 -0.000000 2.677812\n1.546036 4.372849 2.677812\n-0.000000 -0.000000 5.355625\nCa Zn Pb\n2 1 1\ndirect\n0.750001 0.750000 0.749998 Ca\n0.250000 0.250000 0.249999 Ca\n0.000000 0.000000 0.000000 Zn\n0.500001 0.500000 0.499999 Pb\n","nsites":4,"nelements":3,"elements":["Ca","Zn","Pb"],"chemical_system":"Ca-Pb-Zn","density":5.392860452611913,"density_atomic":0.036825155280018666,"volume":108.6214021253673,"volume_molar":16.353334328688128,"formula_full":"Ca2 Zn1 Pb1","formula_reduced":"Ca2ZnPb","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-20993","created_at":"2022-09-04T14:38:39.564733Z","updated_at":"2022-09-04T14:38:39.564766Z","structure_string":"K4 Tb2 F12\n1.0\n6.632561 0.095309 -0.069967\n-3.232933 5.792071 -0.069967\n-0.042500 -0.073601 7.318472\nTb K F\n2 4 12\ndirect\n0.041106 0.958894 0.249999 Tb\n0.958894 0.041106 0.749999 Tb\n0.369556 0.691478 0.002735 K\n0.308522 0.630445 0.497264 K\n0.691479 0.369555 0.502734 K\n0.630445 0.308522 0.997264 K\n0.009604 0.404858 0.782784 F\n0.595142 0.990396 0.717215 F\n0.670042 0.706257 0.297416 F\n0.157912 0.944547 0.955812 F\n0.706257 0.670042 0.797416 F\n0.404858 0.009604 0.282784 F\n0.990396 0.595142 0.217215 F\n0.944547 0.157912 0.455812 F\n0.842088 0.055453 0.044187 F\n0.055453 0.842088 0.544187 F\n0.329959 0.293743 0.702582 F\n0.293743 0.329958 0.202583 F\n","nsites":18,"nelements":3,"elements":["Tb","K","F"],"chemical_system":"F-K-Tb","density":4.115513450569639,"density_atomic":0.06352889597035509,"volume":283.33563373113645,"volume_molar":9.479372603626153,"formula_full":"K4 Tb2 F12","formula_reduced":"K2TbF6","formula_anonymous":"AB2C6","energy_above_hull":0.0,"spacegroup":15}]}