{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=energy_above_hull&page=71","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=energy_above_hull&page=69","results":[{"id":"jvasp-15780","created_at":"2022-09-04T14:35:41.810833Z","updated_at":"2022-09-04T14:35:41.810862Z","structure_string":"Pr3 Mg3 Ga3\n1.0\n3.751203 -6.497275 -0.000000\n3.751203 6.497275 -0.000000\n-0.000000 0.000000 4.531272\nPr Mg Ga\n3 3 3\ndirect\n0.580034 -0.000000 0.000000 Pr\n0.419965 0.419965 0.000000 Pr\n-0.000000 0.580034 0.000000 Pr\n0.243118 -0.000000 0.500000 Mg\n0.756881 0.756881 0.500000 Mg\n-0.000000 0.243118 0.500000 Mg\n0.333333 0.666666 0.500000 Ga\n0.666666 0.333333 0.500000 Ga\n0.000000 0.000000 0.000000 Ga\n","nsites":9,"nelements":3,"elements":["Pr","Mg","Ga"],"chemical_system":"Ga-Mg-Pr","density":5.298675597069544,"density_atomic":0.04074652395005659,"volume":220.87773698270283,"volume_molar":14.779520254001046,"formula_full":"Pr3 Mg3 Ga3","formula_reduced":"PrMgGa","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":189},{"id":"jvasp-91866","created_at":"2022-09-04T14:35:46.169419Z","updated_at":"2022-09-04T14:35:46.169451Z","structure_string":"Mg7 Cd1\n1.0\n6.332018 0.000000 0.000000\n-3.166009 5.483688 0.000000\n0.000000 -0.000000 5.136831\nMg Cd\n7 1\ndirect\n0.164965 0.832482 0.250000 Mg\n0.667518 0.335036 0.250000 Mg\n0.667518 0.832482 0.250000 Mg\n0.333143 0.166858 0.750000 Mg\n0.333143 0.666287 0.750000 Mg\n0.833713 0.166858 0.750000 Mg\n0.833333 0.666667 0.750000 Mg\n0.166667 0.333333 0.250000 Cd\n","nsites":8,"nelements":2,"elements":["Mg","Cd"],"chemical_system":"Cd-Mg","density":2.630438213390585,"density_atomic":0.04485179528146294,"volume":178.3652125806069,"volume_molar":13.426755210596719,"formula_full":"Mg7 Cd1","formula_reduced":"Mg7Cd","formula_anonymous":"AB7","energy_above_hull":0.0,"spacegroup":187},{"id":"jvasp-69369","created_at":"2022-09-04T14:35:44.459937Z","updated_at":"2022-09-04T14:35:44.459965Z","structure_string":"K2 Ba1 Zn1\n1.0\n4.230659 -0.000000 0.000000\n-0.000000 4.230659 -0.000000\n0.000000 -0.000000 11.013340\nK Ba Zn\n2 1 1\ndirect\n0.000000 0.000000 0.989886 K\n0.500000 0.500000 0.318564 K\n0.500000 0.500000 0.671703 Ba\n0.000000 0.000000 0.519847 Zn\n","nsites":4,"nelements":3,"elements":["K","Ba","Zn"],"chemical_system":"Ba-K-Zn","density":2.3665525132939855,"density_atomic":0.020292002218202144,"volume":197.1219969812519,"volume_molar":29.677410317834852,"formula_full":"K2 Ba1 Zn1","formula_reduced":"K2BaZn","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":99},{"id":"jvasp-66568","created_at":"2022-09-04T14:35:44.400768Z","updated_at":"2022-09-04T14:35:44.400795Z","structure_string":"Ba1 Tl1 In1\n1.0\n0.000000 3.964234 3.964234\n3.964234 -0.000000 3.964234\n3.964234 3.964234 -0.000000\nBa Tl In\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 In\n","nsites":3,"nelements":3,"elements":["Ba","Tl","In"],"chemical_system":"Ba-In-Tl","density":6.0842767500030615,"density_atomic":0.02407761207178782,"volume":124.5970734579263,"volume_molar":25.011370488256407,"formula_full":"Ba1 Tl1 In1","formula_reduced":"BaTlIn","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-22708","created_at":"2022-09-04T14:35:46.540256Z","updated_at":"2022-09-04T14:35:46.540287Z","structure_string":"Rb4 I2 O1\n1.0\n-2.757202 2.757202 9.060444\n2.757202 -2.757202 9.060444\n2.757202 2.757202 -9.060444\nRb I O\n4 2 1\ndirect\n0.500000 0.000000 0.500000 Rb\n0.149512 0.149512 0.000000 Rb\n0.850487 0.850487 0.000000 Rb\n0.000000 0.500000 0.500000 Rb\n0.354888 0.354888 0.000000 I\n0.645112 0.645112 0.000000 I\n0.000000 0.000000 0.000000 O\n","nsites":7,"nelements":3,"elements":["Rb","I","O"],"chemical_system":"I-O-Rb","density":3.6866033216527496,"density_atomic":0.025406883636918905,"volume":275.51588380671194,"volume_molar":23.70279191285463,"formula_full":"Rb4 I2 O1","formula_reduced":"Rb4I2O","formula_anonymous":"AB2C4","energy_above_hull":0.0,"spacegroup":139},{"id":"jvasp-105614","created_at":"2022-09-04T14:35:45.675421Z","updated_at":"2022-09-04T14:35:45.675437Z","structure_string":"K3 Y1 Cl6\n1.0\n6.750588 -0.000000 3.897453\n2.250196 6.364515 3.897453\n-0.000000 -0.000000 7.794907\nK Y Cl\n3 1 6\ndirect\n0.750000 0.750001 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 K\n0.000000 0.000000 0.000000 Y\n0.763038 0.236962 0.236961 Cl\n0.236962 0.236962 0.763038 Cl\n0.236962 0.763039 0.763037 Cl\n0.236962 0.763039 0.236961 Cl\n0.763038 0.236962 0.763038 Cl\n0.763039 0.763039 0.236961 Cl\n","nsites":10,"nelements":3,"elements":["K","Y","Cl"],"chemical_system":"Cl-K-Y","density":2.0771173863162367,"density_atomic":0.02985947341760762,"volume":334.90208819634347,"volume_molar":20.16827515936315,"formula_full":"K3 Y1 Cl6","formula_reduced":"K3YCl6","formula_anonymous":"AB3C6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-91949","created_at":"2022-09-04T14:35:42.896315Z","updated_at":"2022-09-04T14:35:42.896335Z","structure_string":"Ce1 Mg6 Al1\n1.0\n7.047364 0.547824 0.000000\n-3.049254 5.281462 0.000000\n0.000000 0.000000 4.934197\nCe Mg Al\n1 6 1\ndirect\n0.114484 0.807240 0.250000 Ce\n0.631771 0.309769 0.250000 Mg\n0.631771 0.822000 0.250000 Mg\n0.348880 0.169566 0.750000 Mg\n0.348880 0.679315 0.750000 Mg\n0.912997 0.206499 0.750000 Mg\n0.791834 0.645917 0.750000 Mg\n0.219382 0.359690 0.250000 Al\n","nsites":8,"nelements":3,"elements":["Ce","Mg","Al"],"chemical_system":"Al-Ce-Mg","density":2.707877892280883,"density_atomic":0.041689451575401916,"volume":191.89506452323423,"volume_molar":14.445238621352486,"formula_full":"Ce1 Mg6 Al1","formula_reduced":"CeMg6Al","formula_anonymous":"ABC6","energy_above_hull":0.0,"spacegroup":38},{"id":"jvasp-97368","created_at":"2022-09-04T14:35:57.703804Z","updated_at":"2022-09-04T14:35:57.703820Z","structure_string":"Pb8 I2 F14\n1.0\n6.045216 0.000000 0.000000\n0.000000 5.946629 -1.439267\n0.000000 -0.042077 12.830645\nPb I F\n8 2 14\ndirect\n0.750000 0.058763 0.117526 Pb\n0.750000 0.653683 0.307366 Pb\n0.250000 0.346317 0.692634 Pb\n0.750000 0.452365 0.904732 Pb\n0.250000 0.547634 0.095269 Pb\n0.750000 0.824578 0.649156 Pb\n0.250000 0.175422 0.350844 Pb\n0.250000 0.941237 0.882474 Pb\n0.750000 0.249784 0.499568 I\n0.250000 0.750216 0.500432 I\n0.500000 0.775000 -0.000000 F\n0.000000 0.225000 -0.000000 F\n0.520335 0.112157 0.757030 F\n0.000000 0.775000 -0.000000 F\n0.500000 0.225000 -0.000000 F\n0.020334 0.355128 0.242971 F\n0.520335 0.644872 0.757030 F\n0.979666 0.112157 0.757030 F\n0.479666 0.887843 0.242970 F\n0.979666 0.644872 0.757030 F\n0.479666 0.355128 0.242971 F\n0.020334 0.887843 0.242970 F\n0.750000 0.561765 0.123530 F\n0.250000 0.438235 0.876470 F\n","nsites":24,"nelements":3,"elements":["Pb","I","F"],"chemical_system":"F-I-Pb","density":7.84509719173405,"density_atomic":0.05207447854484066,"volume":460.87835482277393,"volume_molar":11.564476358249873,"formula_full":"Pb8 I2 F14","formula_reduced":"Pb4IF7","formula_anonymous":"AB4C7","energy_above_hull":0.0,"spacegroup":63},{"id":"jvasp-106136","created_at":"2022-09-04T14:35:56.116566Z","updated_at":"2022-09-04T14:35:56.116591Z","structure_string":"Ba3 Sr1 Ag4\n1.0\n4.951587 0.000000 0.000000\n0.000000 6.529558 0.085964\n0.000000 0.004218 8.519610\nBa Sr Ag\n3 1 4\ndirect\n0.500000 0.367469 0.182619 Ba\n0.000000 0.867043 0.321440 Ba\n0.000000 0.634203 0.817686 Ba\n0.500000 0.134442 0.681177 Sr\n0.500000 0.621329 0.541064 Ag\n0.500000 0.883775 0.028991 Ag\n0.000000 0.365888 0.473117 Ag\n0.000000 0.125852 0.953902 Ag\n","nsites":8,"nelements":3,"elements":["Ba","Sr","Ag"],"chemical_system":"Ag-Ba-Sr","density":5.612910555546304,"density_atomic":0.02904322939854676,"volume":275.4514620333611,"volume_molar":20.735093461408706,"formula_full":"Ba3 Sr1 Ag4","formula_reduced":"Ba3SrAg4","formula_anonymous":"AB3C4","energy_above_hull":0.0,"spacegroup":6},{"id":"jvasp-3648","created_at":"2022-09-04T14:35:49.009044Z","updated_at":"2022-09-04T14:35:49.009071Z","structure_string":"Hg2 Br4\n1.0\n4.149853 -0.121358 0.000000\n-1.632661 3.817122 0.000000\n0.000000 0.000000 12.469954\nHg Br\n2 4\ndirect\n0.660966 0.339033 0.500213 Hg\n0.339034 0.660966 0.000213 Hg\n0.607454 0.392545 0.134364 Br\n0.392545 0.607454 0.634364 Br\n0.071343 0.928656 0.865422 Br\n0.928656 0.071343 0.365422 Br\n","nsites":6,"nelements":2,"elements":["Hg","Br"],"chemical_system":"Br-Hg","density":6.136127471758814,"density_atomic":0.03075984608877231,"volume":195.05949355806652,"volume_molar":19.577928779683162,"formula_full":"Hg2 Br4","formula_reduced":"HgBr2","formula_anonymous":"AB2","energy_above_hull":0.0,"spacegroup":36},{"id":"jvasp-90712","created_at":"2022-09-04T14:35:41.820635Z","updated_at":"2022-09-04T14:35:41.820662Z","structure_string":"Rb1 Cd4 As3\n1.0\n-2.271038 -3.933552 0.000000\n2.271038 -3.933552 0.000000\n-0.000000 -2.622368 12.392272\nRb Cd As\n1 4 3\ndirect\n0.500000 0.500000 0.500000 Rb\n0.087072 0.087072 0.738782 Cd\n0.912927 0.912927 0.261218 Cd\n0.302139 0.302139 0.093584 Cd\n0.697861 0.697861 0.906416 Cd\n0.229818 0.229818 0.310544 As\n0.770182 0.770182 0.689456 As\n0.000000 0.000000 0.000000 As\n","nsites":8,"nelements":3,"elements":["Rb","Cd","As"],"chemical_system":"As-Cd-Rb","density":5.699043062568501,"density_atomic":0.036132645255242145,"volume":221.40643020979363,"volume_molar":16.66675859865617,"formula_full":"Rb1 Cd4 As3","formula_reduced":"RbCd4As3","formula_anonymous":"AB3C4","energy_above_hull":0.0,"spacegroup":166},{"id":"jvasp-103558","created_at":"2022-09-04T14:37:05.809235Z","updated_at":"2022-09-04T14:37:05.809257Z","structure_string":"Na2 In1 Ag1 Cl6\n1.0\n6.321255 -0.000000 3.649579\n2.107085 5.959737 3.649579\n-0.000000 -0.000000 7.299157\nNa In Ag Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 In\n0.500001 0.500000 0.500000 Ag\n0.755268 0.244733 0.244733 Cl\n0.244733 0.244733 0.755267 Cl\n0.244734 0.755267 0.755267 Cl\n0.244734 0.755267 0.244733 Cl\n0.755268 0.244733 0.755267 Cl\n0.755268 0.755267 0.244733 Cl\n","nsites":10,"nelements":4,"elements":["Na","In","Ag","Cl"],"chemical_system":"Ag-Cl-In-Na","density":2.906948933986559,"density_atomic":0.03636611348986555,"volume":274.9812680089332,"volume_molar":16.55975902313081,"formula_full":"Na2 In1 Ag1 Cl6","formula_reduced":"Na2InAgCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225}]}