{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=3403","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=3401","results":[{"id":"jvasp-106673","created_at":"2022-09-04T14:36:51.131520Z","updated_at":"2022-09-04T14:36:51.131556Z","structure_string":"Ce4 Y2 Si4\n1.0\n7.551592 0.000000 0.000000\n0.000000 7.551592 0.000000\n0.000000 0.000000 4.337987\nCe Y Si\n4 2 4\ndirect\n0.677980 0.177980 0.500000 Ce\n0.322019 0.822019 0.500000 Ce\n0.177980 0.322019 0.500000 Ce\n0.822019 0.677980 0.500000 Ce\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 -0.000000 Y\n0.116317 0.616317 -0.000000 Si\n0.883683 0.383683 -0.000000 Si\n0.616317 0.883683 -0.000000 Si\n0.383683 0.116317 -0.000000 Si\n","nsites":10,"nelements":3,"elements":["Ce","Y","Si"],"chemical_system":"Ce-Si-Y","density":5.709764962943778,"density_atomic":0.04042357492119708,"volume":247.38039669906232,"volume_molar":14.897595701863926,"formula_full":"Ce4 Y2 Si4","formula_reduced":"Ce2YSi2","formula_anonymous":"AB2C2","energy_above_hull":2.7539907299999995,"spacegroup":127},{"id":"jvasp-102718","created_at":"2022-09-04T14:36:51.173330Z","updated_at":"2022-09-04T14:36:51.173356Z","structure_string":"Li1 Er1 S2\n1.0\n3.868753 0.000000 0.000000\n0.000000 3.868753 0.000000\n-0.000000 -0.000000 5.269680\nLi Er S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Er\n0.000000 0.000000 0.500000 S\n0.500000 0.500000 -0.000000 S\n","nsites":4,"nelements":3,"elements":["Li","Er","S"],"chemical_system":"Er-Li-S","density":5.017663820823429,"density_atomic":0.050714686066882876,"volume":78.87261679436943,"volume_molar":11.874550011130818,"formula_full":"Li1 Er1 S2","formula_reduced":"LiErS2","formula_anonymous":"ABC2","energy_above_hull":0.971115,"spacegroup":123},{"id":"jvasp-80329","created_at":"2022-09-04T14:36:51.181866Z","updated_at":"2022-09-04T14:36:51.181888Z","structure_string":"Mn1 Fe2 Ge1\n1.0\n-8.461098 -0.000000 -4.885018\n-5.421498 0.099229 -0.379723\n-4.674309 2.212601 -1.673894\nMn Fe Ge\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.783233 -0.000000 0.000000 Fe\n0.216767 -0.000000 0.000000 Fe\n0.500000 -0.000000 0.000000 Ge\n","nsites":4,"nelements":3,"elements":["Mn","Fe","Ge"],"chemical_system":"Fe-Ge-Mn","density":7.847471513256823,"density_atomic":0.07900524799164778,"volume":50.629548057653956,"volume_molar":7.622456625459417,"formula_full":"Mn1 Fe2 Ge1","formula_reduced":"MnFe2Ge","formula_anonymous":"ABC2","energy_above_hull":3.0966585478448274,"spacegroup":71},{"id":"jvasp-18854","created_at":"2022-09-04T14:36:53.490775Z","updated_at":"2022-09-04T14:36:53.490801Z","structure_string":"U1 Ga3 Ni1\n1.0\n3.749157 0.000000 -1.545496\n-0.637092 3.694631 -1.545496\n0.265222 0.314871 5.963606\nU Ga Ni\n1 3 1\ndirect\n0.000000 0.000000 0.000000 U\n0.616079 0.616078 0.232154 Ga\n0.750000 0.250000 0.500000 Ga\n0.383922 0.383922 0.767845 Ga\n0.250000 0.750000 0.500000 Ni\n","nsites":5,"nelements":3,"elements":["U","Ga","Ni"],"chemical_system":"Ga-Ni-U","density":9.739137537440062,"density_atomic":0.05796744873096572,"volume":86.25530551129883,"volume_molar":10.388831821716906,"formula_full":"U1 Ga3 Ni1","formula_reduced":"UGa3Ni","formula_anonymous":"ABC3","energy_above_hull":1.1760990750000002,"spacegroup":119},{"id":"jvasp-53096","created_at":"2022-09-04T14:36:53.598499Z","updated_at":"2022-09-04T14:36:53.598511Z","structure_string":"Ce1 Mo6 S8\n1.0\n6.501412 -0.003876 0.128824\n0.126220 6.500189 0.128824\n-0.003955 -0.003876 6.502688\nCe Mo S\n1 6 8\ndirect\n0.000000 0.000000 0.000000 Ce\n0.437752 0.775148 0.579601 Mo\n0.579600 0.437752 0.775148 Mo\n0.775148 0.579601 0.437752 Mo\n0.224851 0.420398 0.562247 Mo\n0.420399 0.562247 0.224851 Mo\n0.562247 0.224851 0.420399 Mo\n0.245502 0.629171 0.874047 S\n0.629171 0.874047 0.245502 S\n0.759445 0.759445 0.759445 S\n0.874046 0.245502 0.629171 S\n0.125953 0.754497 0.370828 S\n0.240554 0.240554 0.240554 S\n0.370828 0.125952 0.754497 S\n0.754497 0.370828 0.125952 S\n","nsites":15,"nelements":3,"elements":["Ce","Mo","S"],"chemical_system":"Ce-Mo-S","density":5.874849940398404,"density_atomic":0.054581991066090935,"volume":274.81591834634906,"volume_molar":11.033200955802537,"formula_full":"Ce1 Mo6 S8","formula_reduced":"Ce(Mo3S4)2","formula_anonymous":"AB6C8","energy_above_hull":4.343138726666667,"spacegroup":148},{"id":"jvasp-59609","created_at":"2022-09-04T14:36:51.080533Z","updated_at":"2022-09-04T14:36:51.080553Z","structure_string":"Mn4 Co4 Si4\n1.0\n3.649415 -0.000000 0.000000\n-0.000000 5.730151 0.000000\n0.000000 0.000000 6.869125\nMn Co Si\n4 4 4\ndirect\n0.750001 0.970540 0.182328 Mn\n0.250000 0.029460 0.817672 Mn\n0.750001 0.470540 0.317672 Mn\n0.250000 0.529460 0.682329 Mn\n0.250000 0.656510 0.059054 Co\n0.750001 0.343490 0.940947 Co\n0.250000 0.156510 0.440946 Co\n0.750001 0.843490 0.559054 Co\n0.250000 0.265217 0.124387 Si\n0.750001 0.734783 0.875614 Si\n0.250000 0.765217 0.375614 Si\n0.750001 0.234783 0.624387 Si\n","nsites":12,"nelements":3,"elements":["Mn","Co","Si"],"chemical_system":"Co-Mn-Si","density":6.564087586049752,"density_atomic":0.08353923755466819,"volume":143.64507447350334,"volume_molar":7.208757149667666,"formula_full":"Mn4 Co4 Si4","formula_reduced":"MnCoSi","formula_anonymous":"ABC","energy_above_hull":3.0353222471264365,"spacegroup":62},{"id":"jvasp-16108","created_at":"2022-09-04T14:36:51.090972Z","updated_at":"2022-09-04T14:36:51.091004Z","structure_string":"Ce2 As2 Pd2\n1.0\n2.185092 -3.784692 0.000000\n2.185092 3.784692 -0.000000\n0.000000 0.000000 7.756585\nCe As Pd\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ce\n0.000000 0.000000 0.000000 Ce\n0.666666 0.333333 0.250000 As\n0.333333 0.666666 0.750000 As\n0.333333 0.666666 0.250000 Pd\n0.666666 0.333333 0.750000 Pd\n","nsites":6,"nelements":3,"elements":["Ce","As","Pd"],"chemical_system":"As-Ce-Pd","density":8.321506757293706,"density_atomic":0.04676817568945199,"volume":128.2923678665796,"volume_molar":12.876578295437387,"formula_full":"Ce2 As2 Pd2","formula_reduced":"CeAsPd","formula_anonymous":"ABC","energy_above_hull":1.4517976500000005,"spacegroup":194},{"id":"jvasp-106697","created_at":"2022-09-04T14:36:51.093165Z","updated_at":"2022-09-04T14:36:51.093187Z","structure_string":"Y1 Sc1 N2\n1.0\n3.188308 0.001519 4.797723\n1.449913 2.839553 4.797723\n0.002479 0.001519 5.760507\nY Sc N\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Sc\n0.254822 0.254822 0.254822 N\n0.745178 0.745178 0.745178 N\n","nsites":4,"nelements":3,"elements":["Y","Sc","N"],"chemical_system":"N-Sc-Y","density":5.160013950283732,"density_atomic":0.07678591319132926,"volume":52.092888314463444,"volume_molar":7.84276765061645,"formula_full":"Y1 Sc1 N2","formula_reduced":"YScN2","formula_anonymous":"ABC2","energy_above_hull":3.4453993,"spacegroup":166},{"id":"jvasp-107388","created_at":"2022-09-04T14:36:51.119279Z","updated_at":"2022-09-04T14:36:51.119305Z","structure_string":"Co1 Pt1 F6\n1.0\n4.457385 0.076252 3.079756\n1.655768 4.139145 3.079756\n0.110580 0.076252 5.416729\nCo Pt F\n1 1 6\ndirect\n0.500000 0.500000 0.500001 Co\n0.000000 0.000000 0.000000 Pt\n0.252918 0.591553 0.905818 F\n0.591552 0.905818 0.252919 F\n0.408447 0.094182 0.747083 F\n0.747082 0.408448 0.094184 F\n0.905817 0.252917 0.591554 F\n0.094183 0.747083 0.408448 F\n","nsites":8,"nelements":3,"elements":["Co","Pt","F"],"chemical_system":"Co-F-Pt","density":6.286175594990298,"density_atomic":0.08229445876109948,"volume":97.21189154696275,"volume_molar":7.317796180520798,"formula_full":"Co1 Pt1 F6","formula_reduced":"CoPtF6","formula_anonymous":"ABC6","energy_above_hull":0.527941749375,"spacegroup":148},{"id":"jvasp-45397","created_at":"2022-09-04T14:36:51.145930Z","updated_at":"2022-09-04T14:36:51.145940Z","structure_string":"Nd4 Pt4 O14\n1.0\n6.422782 0.000000 3.708195\n2.140927 6.055457 3.708195\n0.000000 0.000000 7.416390\nNd Pt O\n4 4 14\ndirect\n0.000000 0.000000 0.000000 Nd\n-0.000000 -0.000000 0.500000 Nd\n0.500000 -0.000000 -0.000000 Nd\n0.000000 0.500000 -0.000001 Nd\n0.500000 0.500000 0.499999 Pt\n0.000000 0.500000 0.499999 Pt\n0.500000 -0.000000 0.500000 Pt\n0.500000 0.500000 -0.000001 Pt\n0.164934 0.585066 0.164933 O\n0.585066 0.164934 0.585065 O\n0.585066 0.164934 0.164934 O\n0.875000 0.875000 0.874999 O\n0.835066 0.414934 0.414933 O\n0.414934 0.835066 0.414933 O\n0.414934 0.414934 0.835065 O\n0.835066 0.835066 0.414933 O\n0.835066 0.414934 0.835065 O\n0.164934 0.585066 0.585065 O\n0.414934 0.835066 0.835065 O\n0.125000 0.125000 0.125000 O\n0.585066 0.585066 0.164933 O\n0.164934 0.164934 0.585066 O\n","nsites":22,"nelements":3,"elements":["Nd","Pt","O"],"chemical_system":"Nd-O-Pt","density":9.103313394623289,"density_atomic":0.07627110089996579,"volume":288.4447679449959,"volume_molar":7.895704518410461,"formula_full":"Nd4 Pt4 O14","formula_reduced":"Nd2Pt2O7","formula_anonymous":"A2B2C7","energy_above_hull":2.601314572727273,"spacegroup":227},{"id":"jvasp-17899","created_at":"2022-09-04T14:36:51.166476Z","updated_at":"2022-09-04T14:36:51.166501Z","structure_string":"Ca1 V1 F6\n1.0\n4.736614 0.117085 3.193899\n1.759400 4.399287 3.193899\n0.168407 0.117085 5.710353\nCa V F\n1 1 6\ndirect\n0.499999 0.500001 0.499999 Ca\n0.000000 0.000000 0.000000 V\n0.362271 0.080589 0.781312 F\n0.080588 0.781314 0.362270 F\n0.218687 0.637731 0.919411 F\n0.919411 0.218689 0.637729 F\n0.637728 0.919414 0.218687 F\n0.781311 0.362272 0.080588 F\n","nsites":8,"nelements":3,"elements":["Ca","V","F"],"chemical_system":"Ca-F-V","density":2.975817753318462,"density_atomic":0.0699314197584788,"volume":114.39779183133263,"volume_molar":8.61149506301829,"formula_full":"Ca1 V1 F6","formula_reduced":"CaVF6","formula_anonymous":"ABC6","energy_above_hull":0.016595789375,"spacegroup":148},{"id":"jvasp-107019","created_at":"2022-09-04T14:36:51.169943Z","updated_at":"2022-09-04T14:36:51.169967Z","structure_string":"Yb1 Y2 Se4\n1.0\n4.113399 0.000000 0.000000\n-0.000000 6.677673 2.182593\n-0.000000 0.023131 7.111270\nYb Y Se\n1 2 4\ndirect\n0.000000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 -0.000000 Y\n0.500000 0.756799 0.246987 Se\n0.000000 0.256176 0.237587 Se\n0.500000 0.243201 0.753012 Se\n0.000000 0.743823 0.762413 Se\n","nsites":7,"nelements":3,"elements":["Yb","Y","Se"],"chemical_system":"Se-Y-Yb","density":5.673655437131547,"density_atomic":0.035874582171290206,"volume":195.12422379101537,"volume_molar":16.786650590789076,"formula_full":"Yb1 Y2 Se4","formula_reduced":"Yb(YSe2)2","formula_anonymous":"AB2C4","energy_above_hull":1.434263580952381,"spacegroup":10}]}