{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=id&page=615","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=id&page=613","results":[{"id":"jvasp-110457","created_at":"2022-09-04T14:38:39.688347Z","updated_at":"2022-09-04T14:38:39.688374Z","structure_string":"Pm2 Tl1 Hg1\n1.0\n4.686402 0.000000 2.705695\n1.562134 4.418382 2.705695\n-0.000000 0.000000 5.411391\nPm Tl Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250001 Pm\n0.749999 0.750000 0.750002 Pm\n0.000000 0.000000 0.000000 Tl\n0.499999 0.500000 0.500001 Hg\n","nsites":4,"nelements":3,"elements":["Pm","Tl","Hg"],"chemical_system":"Hg-Pm-Tl","density":10.299247664498237,"density_atomic":0.03569836088905496,"volume":112.04996252997127,"volume_molar":16.86951616270532,"formula_full":"Pm2 Tl1 Hg1","formula_reduced":"Pm2TlHg","formula_anonymous":"ABC2","energy_above_hull":0.1126623874999999,"spacegroup":225},{"id":"jvasp-110458","created_at":"2022-09-04T14:38:40.016271Z","updated_at":"2022-09-04T14:38:40.016302Z","structure_string":"Pm3 Ga1\n1.0\n4.788375 0.000000 0.000000\n0.000000 4.788375 -0.000000\n-0.000000 0.000000 4.788375\nPm Ga\n3 1\ndirect\n0.000000 0.500000 0.500000 Pm\n0.500000 0.000000 0.500000 Pm\n0.500000 0.500000 0.000000 Pm\n0.000000 0.000000 0.000000 Ga\n","nsites":4,"nelements":2,"elements":["Pm","Ga"],"chemical_system":"Ga-Pm","density":7.633746417136574,"density_atomic":0.03643304978455817,"volume":109.79042445399025,"volume_molar":16.529334754051888,"formula_full":"Pm3 Ga1","formula_reduced":"Pm3Ga","formula_anonymous":"AB3","energy_above_hull":1.0133889625,"spacegroup":221},{"id":"jvasp-110459","created_at":"2022-09-04T14:38:38.717469Z","updated_at":"2022-09-04T14:38:38.717485Z","structure_string":"Pr2 Er6\n1.0\n7.168405 0.000000 -0.000000\n-3.584203 6.208021 0.000000\n-0.000000 0.000000 5.635191\nPr Er\n2 6\ndirect\n0.333333 0.666667 0.750000 Pr\n0.666668 0.333333 0.250000 Pr\n0.164444 0.328888 0.250000 Er\n0.671113 0.835556 0.250000 Er\n0.164444 0.835556 0.250000 Er\n0.835557 0.671112 0.750000 Er\n0.328888 0.164444 0.750000 Er\n0.835557 0.164444 0.750000 Er\n","nsites":8,"nelements":2,"elements":["Pr","Er"],"chemical_system":"Er-Pr","density":8.511236695007314,"density_atomic":0.03190109826754019,"volume":250.77506526288195,"volume_molar":18.87753427639077,"formula_full":"Pr2 Er6","formula_reduced":"PrEr3","formula_anonymous":"AB3","energy_above_hull":1.4492649625,"spacegroup":194},{"id":"jvasp-11046","created_at":"2022-09-04T14:37:19.707826Z","updated_at":"2022-09-04T14:37:19.707836Z","structure_string":"Sr4 Mn2 Cu2 S2 O6\n1.0\n3.877164 0.000000 -0.000000\n-0.000000 3.877164 -0.000000\n0.000000 0.000000 15.832524\nSr Mn Cu S O\n4 2 2 2 6\ndirect\n0.500000 0.000000 0.184270 Sr\n0.000000 0.500000 0.815730 Sr\n0.500000 0.000000 0.413700 Sr\n0.000000 0.500000 0.586300 Sr\n0.000000 0.500000 0.305932 Mn\n0.500000 0.000000 0.694068 Mn\n0.500000 0.500000 0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.092040 S\n0.500000 0.000000 0.907960 S\n0.500000 0.500000 0.288580 O\n0.000000 0.000000 0.288580 O\n0.000000 0.000000 0.711420 O\n0.500000 0.500000 0.711420 O\n0.000000 0.500000 0.430437 O\n0.500000 0.000000 0.569563 O\n","nsites":16,"nelements":5,"elements":["Sr","Mn","Cu","S","O"],"chemical_system":"Cu-Mn-O-S-Sr","density":5.215849750362551,"density_atomic":0.0672266521893736,"volume":238.0008445895673,"volume_molar":8.957966169482866,"formula_full":"Sr4 Mn2 Cu2 S2 O6","formula_reduced":"Sr2MnCuSO3","formula_anonymous":"ABCD2E3","energy_above_hull":1.453163851422414,"spacegroup":129},{"id":"jvasp-110460","created_at":"2022-09-04T14:38:38.606600Z","updated_at":"2022-09-04T14:38:38.606627Z","structure_string":"Pm1 Dy3\n1.0\n4.987479 -0.000000 0.000000\n0.000000 4.987479 0.000000\n-0.000000 0.000000 4.987479\nPm Dy\n1 3\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500000 0.500000 0.000000 Dy\n0.500000 0.000000 0.500000 Dy\n0.000000 0.500000 0.500000 Dy\n","nsites":4,"nelements":2,"elements":["Pm","Dy"],"chemical_system":"Dy-Pm","density":8.465768475238171,"density_atomic":0.03224161227957195,"volume":124.06327466862973,"volume_molar":18.678162580025766,"formula_full":"Pm1 Dy3","formula_reduced":"PmDy3","formula_anonymous":"AB3","energy_above_hull":1.45460516875,"spacegroup":221},{"id":"jvasp-110461","created_at":"2022-09-04T14:38:37.594795Z","updated_at":"2022-09-04T14:38:37.594816Z","structure_string":"Pm1 Tm1\n1.0\n3.581880 0.000000 0.000000\n-1.790940 3.101998 -0.000000\n0.000000 0.000000 5.666460\nPm Tm\n1 1\ndirect\n0.333333 0.666667 0.500000 Pm\n0.000000 0.000000 0.000000 Tm\n","nsites":2,"nelements":2,"elements":["Pm","Tm"],"chemical_system":"Pm-Tm","density":8.279867152188634,"density_atomic":0.03176622610311359,"volume":62.959949775210106,"volume_molar":18.95768398944228,"formula_full":"Pm1 Tm1","formula_reduced":"PmTm","formula_anonymous":"AB","energy_above_hull":0.9933627125,"spacegroup":187},{"id":"jvasp-110462","created_at":"2022-09-04T14:38:37.311034Z","updated_at":"2022-09-04T14:38:37.311073Z","structure_string":"Pr2 Tl1 Hg1\n1.0\n4.757921 0.000000 2.746987\n1.585974 4.485811 2.746987\n0.000000 0.000000 5.493974\nPr Tl Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pr\n0.749999 0.750000 0.750001 Pr\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Hg\n","nsites":4,"nelements":3,"elements":["Pr","Tl","Hg"],"chemical_system":"Hg-Pr-Tl","density":9.7258457396917,"density_atomic":0.03411262916985543,"volume":117.25862524647357,"volume_molar":17.65369866395884,"formula_full":"Pr2 Tl1 Hg1","formula_reduced":"Pr2TlHg","formula_anonymous":"ABC2","energy_above_hull":0.1646567250000001,"spacegroup":225},{"id":"jvasp-110463","created_at":"2022-09-04T14:38:37.599272Z","updated_at":"2022-09-04T14:38:37.599281Z","structure_string":"Pr1 Nd1\n1.0\n3.682731 -0.000000 -0.000000\n-1.841365 3.189339 0.000000\n-0.000000 0.000000 5.998591\nPr Nd\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.333334 0.666667 0.500000 Nd\n","nsites":2,"nelements":2,"elements":["Pr","Nd"],"chemical_system":"Nd-Pr","density":6.72050653295699,"density_atomic":0.02838638331413192,"volume":70.45631625090883,"volume_molar":21.21489269470242,"formula_full":"Pr1 Nd1","formula_reduced":"PrNd","formula_anonymous":"AB","energy_above_hull":1.1224506750000005,"spacegroup":187},{"id":"jvasp-110464","created_at":"2022-09-04T14:38:38.293197Z","updated_at":"2022-09-04T14:38:38.293214Z","structure_string":"Sr1 Ta1 O3\n1.0\n4.057605 -0.000000 -0.000000\n-0.000000 4.057605 -0.000000\n-0.000000 -0.000000 4.057605\nSr Ta O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500001 0.500001 0.500001 Ta\n0.500001 0.500001 0.000000 O\n0.500001 0.000000 0.500001 O\n0.000000 0.500001 0.500001 O\n","nsites":5,"nelements":3,"elements":["Sr","Ta","O"],"chemical_system":"O-Sr-Ta","density":7.868721506467226,"density_atomic":0.07484463990829444,"volume":66.80505118504671,"volume_molar":8.046188434307123,"formula_full":"Sr1 Ta1 O3","formula_reduced":"SrTaO3","formula_anonymous":"ABC3","energy_above_hull":2.225323202,"spacegroup":221},{"id":"jvasp-110466","created_at":"2022-09-04T14:38:38.304505Z","updated_at":"2022-09-04T14:38:38.304526Z","structure_string":"Sc2 Pd1 Rh1\n1.0\n3.991473 -0.000000 2.304478\n1.330491 3.763196 2.304478\n0.000000 0.000000 4.608956\nSc Pd Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sc\n0.749999 0.750001 0.750001 Sc\n0.499999 0.500000 0.500001 Pd\n0.000000 0.000000 0.000000 Rh\n","nsites":4,"nelements":3,"elements":["Sc","Pd","Rh"],"chemical_system":"Pd-Rh-Sc","density":7.177484501267101,"density_atomic":0.05777865061283079,"volume":69.22972339391616,"volume_molar":10.422778476350702,"formula_full":"Sc2 Pd1 Rh1","formula_reduced":"Sc2PdRh","formula_anonymous":"ABC2","energy_above_hull":2.1897498,"spacegroup":225},{"id":"jvasp-110467","created_at":"2022-09-04T14:38:37.990602Z","updated_at":"2022-09-04T14:38:37.990637Z","structure_string":"Sc1 Pb3\n1.0\n4.192124 -0.075513 -4.626599\n-0.679002 4.137458 -4.626599\n0.065310 0.075513 6.243001\nSc Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Sc\n0.750000 0.250000 0.500000 Pb\n0.250000 0.750000 0.500000 Pb\n0.500000 0.500001 0.000000 Pb\n","nsites":4,"nelements":2,"elements":["Sc","Pb"],"chemical_system":"Pb-Sc","density":9.977129660584888,"density_atomic":0.03605619761876892,"volume":110.93793201082897,"volume_molar":16.70209605481305,"formula_full":"Sc1 Pb3","formula_reduced":"ScPb3","formula_anonymous":"AB3","energy_above_hull":0.8072144274999999,"spacegroup":139},{"id":"jvasp-110468","created_at":"2022-09-04T14:38:38.887911Z","updated_at":"2022-09-04T14:38:38.887929Z","structure_string":"Sn3 Ge1\n1.0\n4.718663 0.000000 0.000000\n0.000000 4.718663 -0.000000\n-0.000000 -0.000000 4.718663\nSn Ge\n3 1\ndirect\n0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.500000 Sn\n0.500000 0.500000 0.000000 Sn\n0.000000 0.000000 0.000000 Ge\n","nsites":4,"nelements":2,"elements":["Sn","Ge"],"chemical_system":"Ge-Sn","density":6.77667414770963,"density_atomic":0.038071773320207586,"volume":105.06471464718707,"volume_molar":15.817862512864856,"formula_full":"Sn3 Ge1","formula_reduced":"Sn3Ge","formula_anonymous":"AB3","energy_above_hull":0.5528027624999999,"spacegroup":221}]}