{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=3538","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=3536","results":[{"id":"jvasp-106629","created_at":"2022-09-04T14:36:54.444345Z","updated_at":"2022-09-04T14:36:54.444373Z","structure_string":"Zr1 Cd1 Ag2\n1.0\n4.134828 -0.000000 2.387244\n1.378276 3.898354 2.387244\n-0.000000 -0.000000 4.774489\nZr Cd Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500001 0.500000 0.499999 Cd\n0.250000 0.250000 0.250000 Ag\n0.750001 0.749999 0.749999 Ag\n","nsites":4,"nelements":3,"elements":["Zr","Cd","Ag"],"chemical_system":"Ag-Cd-Zr","density":9.048618691691066,"density_atomic":0.05197498490718436,"volume":76.96009930821724,"volume_molar":11.58661377344157,"formula_full":"Zr1 Cd1 Ag2","formula_reduced":"ZrCdAg2","formula_anonymous":"ABC2","energy_above_hull":0.4355596925,"spacegroup":225},{"id":"jvasp-107293","created_at":"2022-09-04T14:36:52.408072Z","updated_at":"2022-09-04T14:36:52.408090Z","structure_string":"Sc2 C1 O1\n1.0\n3.100552 0.001681 4.674821\n1.410617 2.761084 4.674821\n0.002744 0.001681 5.609577\nSc C O\n2 1 1\ndirect\n0.246695 0.246695 0.246696 Sc\n0.753305 0.753303 0.753306 Sc\n0.500000 0.499999 0.500001 C\n0.000000 0.000000 0.000000 O\n","nsites":4,"nelements":3,"elements":["Sc","C","O"],"chemical_system":"C-O-Sc","density":4.082778002414563,"density_atomic":0.08340116238560993,"volume":47.96096224061934,"volume_molar":7.220691639951367,"formula_full":"Sc2 C1 O1","formula_reduced":"Sc2CO","formula_anonymous":"ABC2","energy_above_hull":2.876691,"spacegroup":166},{"id":"jvasp-2952","created_at":"2022-09-04T14:36:52.413779Z","updated_at":"2022-09-04T14:36:52.413801Z","structure_string":"Ba2 Hf1 S4\n1.0\n4.742363 -0.000000 -1.384179\n-0.404008 4.725122 -1.384179\n-0.047539 -0.051777 8.653161\nBa Hf S\n2 1 4\ndirect\n0.357697 0.357698 0.715397 Ba\n0.642301 0.642301 0.284602 Ba\n0.000000 0.000000 0.000000 Hf\n-0.000000 0.500000 -0.000000 S\n0.500000 -0.000000 -0.000000 S\n0.837756 0.837757 0.675513 S\n0.162242 0.162242 0.324486 S\n","nsites":7,"nelements":3,"elements":["Ba","Hf","S"],"chemical_system":"Ba-Hf-S","density":4.996543578999559,"density_atomic":0.03622768699497349,"volume":193.22238267574838,"volume_molar":16.623034092227744,"formula_full":"Ba2 Hf1 S4","formula_reduced":"Ba2HfS4","formula_anonymous":"AB2C4","energy_above_hull":1.7492064199999997,"spacegroup":139},{"id":"jvasp-2044","created_at":"2022-09-04T14:36:52.424668Z","updated_at":"2022-09-04T14:36:52.424678Z","structure_string":"Ca2 As1 I1\n1.0\n4.197275 0.004510 6.596899\n1.924115 3.730271 6.596899\n0.007392 0.004510 7.818960\nCa As I\n2 1 1\ndirect\n0.231976 0.231977 0.231977 Ca\n0.768021 0.768023 0.768025 Ca\n0.499999 0.500000 0.500001 As\n0.000000 0.000000 0.000000 I\n","nsites":4,"nelements":3,"elements":["Ca","As","I"],"chemical_system":"As-Ca-I","density":3.8347796336250934,"density_atomic":0.032758937822184496,"volume":122.10408108199351,"volume_molar":18.38319909115545,"formula_full":"Ca2 As1 I1","formula_reduced":"Ca2AsI","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":166},{"id":"jvasp-104743","created_at":"2022-09-04T14:36:52.430142Z","updated_at":"2022-09-04T14:36:52.430157Z","structure_string":"Ga4 Bi3 As1\n1.0\n4.440708 0.035806 14.062344\n2.197396 3.859096 14.062344\n0.061025 0.035806 14.746717\nGa Bi As\n4 3 1\ndirect\n0.057130 0.057130 0.057130 Ga\n0.810520 0.810523 0.810519 Ga\n0.564052 0.564054 0.564051 Ga\n0.317699 0.317701 0.317699 Ga\n0.747009 0.747012 0.747008 Bi\n0.500291 0.500293 0.500290 Bi\n0.253413 0.253414 0.253413 Bi\n-0.000117 -0.000117 -0.000117 As\n","nsites":8,"nelements":3,"elements":["Ga","Bi","As"],"chemical_system":"As-Bi-Ga","density":6.589567708968426,"density_atomic":0.03236960292596868,"volume":247.14544748344625,"volume_molar":18.604308411731264,"formula_full":"Ga4 Bi3 As1","formula_reduced":"Ga4Bi3As","formula_anonymous":"AB3C4","energy_above_hull":0.4707804937500001,"spacegroup":160},{"id":"jvasp-1489","created_at":"2022-09-04T14:36:52.441013Z","updated_at":"2022-09-04T14:36:52.441032Z","structure_string":"Nd1 Cu1 O2\n1.0\n3.564851 -0.003356 4.986226\n1.596662 3.187295 4.986226\n-0.005440 -0.003356 6.129485\nNd Cu O\n1 1 2\ndirect\n0.500000 0.499999 0.500002 Nd\n0.000000 0.000000 0.000000 Cu\n0.894171 0.894171 0.894175 O\n0.105828 0.105828 0.105829 O\n","nsites":4,"nelements":3,"elements":["Nd","Cu","O"],"chemical_system":"Cu-Nd-O","density":5.704766741301009,"density_atomic":0.05730909012665168,"volume":69.79695526765646,"volume_molar":10.508177231031265,"formula_full":"Nd1 Cu1 O2","formula_reduced":"NdCuO2","formula_anonymous":"ABC2","energy_above_hull":0.8973947375000002,"spacegroup":166},{"id":"jvasp-100499","created_at":"2022-09-04T14:36:52.450741Z","updated_at":"2022-09-04T14:36:52.450772Z","structure_string":"Pm1 Tm1 Al2\n1.0\n4.437252 0.000000 2.561849\n1.479084 4.183481 2.561849\n0.000000 0.000000 5.123698\nPm Tm Al\n1 1 2\ndirect\n0.499999 0.500000 0.500001 Pm\n0.000000 0.000000 0.000000 Tm\n0.749999 0.750000 0.750001 Al\n0.250000 0.250000 0.250000 Al\n","nsites":4,"nelements":3,"elements":["Pm","Tm","Al"],"chemical_system":"Al-Pm-Tm","density":6.423034643555098,"density_atomic":0.042055671611608836,"volume":95.11202286675314,"volume_molar":14.319449741798152,"formula_full":"Pm1 Tm1 Al2","formula_reduced":"PmTmAl2","formula_anonymous":"ABC2","energy_above_hull":1.4757277562500002,"spacegroup":225},{"id":"jvasp-14891","created_at":"2022-09-04T14:36:52.452821Z","updated_at":"2022-09-04T14:36:52.452833Z","structure_string":"Al2 B2 Mo2\n1.0\n3.115331 0.000000 0.000000\n0.000000 3.154799 -0.724578\n0.000000 -0.006011 7.204093\nAl B Mo\n2 2 2\ndirect\n0.750000 0.301578 0.603156 Al\n0.250000 0.698422 0.396843 Al\n0.250000 0.532984 0.065968 B\n0.750000 0.467017 0.934031 B\n0.250000 0.910467 0.820933 Mo\n0.750000 0.089533 0.179067 Mo\n","nsites":6,"nelements":3,"elements":["Al","B","Mo"],"chemical_system":"Al-B-Mo","density":6.273995678480274,"density_atomic":0.08475772353990939,"volume":70.7900088559459,"volume_molar":7.10512329553588,"formula_full":"Al2 B2 Mo2","formula_reduced":"AlBMo","formula_anonymous":"ABC","energy_above_hull":3.458557094444444,"spacegroup":63},{"id":"jvasp-102433","created_at":"2022-09-04T14:36:52.470718Z","updated_at":"2022-09-04T14:36:52.470739Z","structure_string":"K3 V1 Se4\n1.0\n6.461439 -0.035028 -4.130033\n-1.955897 6.158400 -4.130033\n0.025773 0.035028 7.668553\nK V Se\n3 1 4\ndirect\n0.500000 0.500000 0.000000 K\n0.750000 0.250000 0.500000 K\n0.249999 0.750000 0.500000 K\n0.000000 0.000000 0.000000 V\n0.295319 0.923549 0.000000 Se\n0.923549 0.295319 0.000000 Se\n0.704680 0.704681 0.628230 Se\n0.076451 0.076451 0.371770 Se\n","nsites":8,"nelements":3,"elements":["K","V","Se"],"chemical_system":"K-Se-V","density":2.6226062426345713,"density_atomic":0.026101175693189038,"volume":306.499603467577,"volume_molar":23.07229693707416,"formula_full":"K3 V1 Se4","formula_reduced":"K3VSe4","formula_anonymous":"AB3C4","energy_above_hull":0.9146027083333332,"spacegroup":121},{"id":"jvasp-7750","created_at":"2022-09-04T14:36:52.473711Z","updated_at":"2022-09-04T14:36:52.473726Z","structure_string":"Nd2 Te2 F2\n1.0\n4.216923 0.000000 0.000000\n0.000000 4.216923 -0.000000\n0.000000 -0.000000 7.572335\nNd Te F\n2 2 2\ndirect\n0.500000 0.000000 0.802552 Nd\n0.000000 0.500000 0.197448 Nd\n0.000000 0.500000 0.643221 Te\n0.500000 0.000000 0.356779 Te\n0.500000 0.500000 0.000000 F\n0.000000 0.000000 0.000000 F\n","nsites":6,"nelements":3,"elements":["Nd","Te","F"],"chemical_system":"F-Nd-Te","density":7.173195548960493,"density_atomic":0.04455845147491585,"volume":134.6545896770604,"volume_molar":13.515148216921677,"formula_full":"Nd2 Te2 F2","formula_reduced":"NdTeF","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":129},{"id":"jvasp-80420","created_at":"2022-09-04T14:36:52.480978Z","updated_at":"2022-09-04T14:36:52.480996Z","structure_string":"Li1 Ge1 Pt2\n1.0\n-9.520252 -2.693438 -3.361799\n-6.650670 -2.456231 0.114042\n-4.076313 1.381786 -1.383654\nLi Ge Pt\n1 1 2\ndirect\n0.000036 -0.000036 0.999964 Li\n0.500038 -0.000040 -0.000035 Ge\n0.747875 0.005679 0.998413 Pt\n0.252049 -0.005601 0.001660 Pt\n","nsites":4,"nelements":3,"elements":["Li","Ge","Pt"],"chemical_system":"Ge-Li-Pt","density":13.05795635087485,"density_atomic":0.06696073963761881,"volume":59.73649666427495,"volume_molar":8.993539785538356,"formula_full":"Li1 Ge1 Pt2","formula_reduced":"LiGePt2","formula_anonymous":"ABC2","energy_above_hull":1.5773921875,"spacegroup":12},{"id":"jvasp-100747","created_at":"2022-09-04T14:36:52.482885Z","updated_at":"2022-09-04T14:36:52.482905Z","structure_string":"Pm1 Ho1 Al2\n1.0\n4.456070 0.000000 2.572713\n1.485357 4.201223 2.572713\n0.000000 0.000000 5.145426\nPm Ho Al\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500001 0.500000 0.500000 Ho\n0.250000 0.250000 0.250000 Al\n0.750001 0.749999 0.749999 Al\n","nsites":4,"nelements":3,"elements":["Pm","Ho","Al"],"chemical_system":"Al-Ho-Pm","density":6.272984252492293,"density_atomic":0.04152512187085853,"volume":96.327230837271,"volume_molar":14.502403578076466,"formula_full":"Pm1 Ho1 Al2","formula_reduced":"PmHoAl2","formula_anonymous":"ABC2","energy_above_hull":1.4867730854166663,"spacegroup":225}]}