{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3532","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3530","results":[{"id":"jvasp-21450","created_at":"2022-09-04T14:38:29.680328Z","updated_at":"2022-09-04T14:38:29.680353Z","structure_string":"Sm2 B4 C4\n1.0\n5.372306 -0.000000 0.000000\n0.000000 5.372306 -0.000000\n-0.000000 -0.000000 3.728254\nSm B C\n2 4 4\ndirect\n0.500000 0.500000 0.000000 Sm\n0.000000 0.000000 0.000000 Sm\n0.137874 0.637874 0.499999 B\n0.637874 0.862127 0.499999 B\n0.362126 0.137874 0.499999 B\n0.862127 0.362126 0.499999 B\n0.839012 0.660989 0.499999 C\n0.339012 0.839012 0.499999 C\n0.160988 0.339012 0.499999 C\n0.660989 0.160988 0.499999 C\n","nsites":10,"nelements":3,"elements":["Sm","B","C"],"chemical_system":"B-C-Sm","density":6.049447644644665,"density_atomic":0.09293365637761966,"volume":107.60364317709345,"volume_molar":6.480042855012704,"formula_full":"Sm2 B4 C4","formula_reduced":"Sm(BC)2","formula_anonymous":"AB2C2","energy_above_hull":4.700860808333333,"spacegroup":127},{"id":"jvasp-108967","created_at":"2022-09-04T14:38:20.057528Z","updated_at":"2022-09-04T14:38:20.057538Z","structure_string":"Li2 Co1 O2\n1.0\n3.538710 -0.002146 -3.526317\n-0.308312 2.679264 -4.205220\n-0.021962 0.002146 4.995688\nLi Co O\n2 1 2\ndirect\n0.804830 0.304829 0.499999 Li\n0.195171 0.695170 0.500000 Li\n0.500000 0.000000 0.500000 Co\n0.356997 0.356996 -0.000001 O\n0.643003 0.643001 -0.000002 O\n","nsites":5,"nelements":3,"elements":["Li","Co","O"],"chemical_system":"Co-Li-O","density":3.6883836317998115,"density_atomic":0.1059589676705599,"volume":47.188077705189095,"volume_molar":5.683464922689329,"formula_full":"Li2 Co1 O2","formula_reduced":"Li2CoO2","formula_anonymous":"AB2C2","energy_above_hull":1.6884475800000005,"spacegroup":71},{"id":"jvasp-17533","created_at":"2022-09-04T14:38:08.317954Z","updated_at":"2022-09-04T14:38:08.317974Z","structure_string":"Ce1 Mg2 Si2\n1.0\n4.205868 0.000000 0.000000\n0.000000 4.205868 -0.000000\n0.000000 0.000000 5.836994\nCe Mg Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.802231 Si\n0.500000 0.500000 0.197768 Si\n","nsites":5,"nelements":3,"elements":["Ce","Mg","Si"],"chemical_system":"Ce-Mg-Si","density":3.9385107836078137,"density_atomic":0.048424983425400636,"volume":103.25248758634207,"volume_molar":12.43602028130209,"formula_full":"Ce1 Mg2 Si2","formula_reduced":"Ce(MgSi)2","formula_anonymous":"AB2C2","energy_above_hull":1.3518741599999995,"spacegroup":123},{"id":"jvasp-109809","created_at":"2022-09-04T14:38:18.952013Z","updated_at":"2022-09-04T14:38:18.952033Z","structure_string":"Li2 Mn1 N2\n1.0\n3.015640 0.000126 0.000206\n-1.507934 2.611423 -0.000027\n-0.000260 -0.000208 5.291894\nLi Mn N\n2 1 2\ndirect\n0.666658 0.333350 0.359424 Li\n0.333343 0.666675 0.640575 Li\n-0.000000 0.000015 0.000000 Mn\n0.666677 0.333357 0.795664 N\n0.333324 0.666668 0.204336 N\n","nsites":5,"nelements":3,"elements":["Li","Mn","N"],"chemical_system":"Li-Mn-N","density":3.8583013414272256,"density_atomic":0.11997525121925161,"volume":41.67526176596731,"volume_molar":5.019485851290027,"formula_full":"Li2 Mn1 N2","formula_reduced":"Li2MnN2","formula_anonymous":"AB2C2","energy_above_hull":3.273594748275862,"spacegroup":164},{"id":"jvasp-17516","created_at":"2022-09-04T14:38:13.453683Z","updated_at":"2022-09-04T14:38:13.453708Z","structure_string":"Ca1 Mn2 Ge2\n1.0\n3.749777 -0.000000 -1.340478\n-0.479197 3.719032 -1.340478\n0.091313 0.103833 6.170377\nCa Mn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.750000 0.249999 0.500000 Mn\n0.249999 0.749999 0.500000 Mn\n0.375866 0.375866 0.751734 Ge\n0.624133 0.624133 0.248266 Ge\n","nsites":5,"nelements":3,"elements":["Ca","Mn","Ge"],"chemical_system":"Ca-Ge-Mn","density":5.629009259956019,"density_atomic":0.05740984402328545,"volume":87.09307759087446,"volume_molar":10.489735449476955,"formula_full":"Ca1 Mn2 Ge2","formula_reduced":"Ca(MnGe)2","formula_anonymous":"AB2C2","energy_above_hull":1.985817360551724,"spacegroup":139},{"id":"jvasp-98349","created_at":"2022-09-04T14:36:08.741871Z","updated_at":"2022-09-04T14:36:08.741891Z","structure_string":"Na1 Sn2 As2\n1.0\n3.958123 -0.017935 8.654629\n1.870819 3.488136 8.654629\n-0.030126 -0.017935 9.516745\nNa Sn As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.211652 0.211652 0.211652 Sn\n0.788347 0.788347 0.788349 Sn\n0.405096 0.405095 0.405097 As\n0.594903 0.594903 0.594905 As\n","nsites":5,"nelements":3,"elements":["Na","Sn","As"],"chemical_system":"As-Na-Sn","density":5.124035409565983,"density_atomic":0.03760809161290167,"volume":132.9501122116157,"volume_molar":16.012885795922895,"formula_full":"Na1 Sn2 As2","formula_reduced":"Na(SnAs)2","formula_anonymous":"AB2C2","energy_above_hull":0.95591118,"spacegroup":166},{"id":"jvasp-92360","created_at":"2022-09-04T14:36:00.572246Z","updated_at":"2022-09-04T14:36:00.572272Z","structure_string":"Ca2 Ga1 Cu2\n1.0\n3.951522 0.000000 -1.603258\n-1.071401 4.673695 -2.640664\n-0.019583 -0.033118 5.622986\nCa Ga Cu\n2 1 2\ndirect\n0.802163 0.302162 0.604324 Ca\n0.197838 0.697837 0.395676 Ca\n0.000000 0.000000 0.000000 Ga\n0.500000 0.737357 -0.000000 Cu\n0.500000 0.262642 -0.000000 Cu\n","nsites":5,"nelements":3,"elements":["Ca","Ga","Cu"],"chemical_system":"Ca-Cu-Ga","density":4.452403535227308,"density_atomic":0.04840398601067705,"volume":103.29727801543223,"volume_molar":12.441414966675726,"formula_full":"Ca2 Ga1 Cu2","formula_reduced":"Ca2GaCu2","formula_anonymous":"AB2C2","energy_above_hull":0.0,"spacegroup":71},{"id":"jvasp-91302","created_at":"2022-09-04T14:36:03.324477Z","updated_at":"2022-09-04T14:36:03.324503Z","structure_string":"Pr4 In2 Pd4\n1.0\n3.915877 -0.000000 0.000000\n-0.000000 7.891371 0.000000\n0.000000 -0.000000 7.891371\nPr In Pd\n4 2 4\ndirect\n0.500000 0.824437 0.324437 Pr\n0.500000 0.675563 0.824437 Pr\n0.500000 0.324437 0.175563 Pr\n0.500000 0.175563 0.675563 Pr\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.500000 In\n0.000000 0.126506 0.373494 Pd\n0.000000 0.373494 0.873494 Pd\n0.000000 0.626506 0.126506 Pd\n0.000000 0.873494 0.626506 Pd\n","nsites":10,"nelements":3,"elements":["Pr","In","Pd"],"chemical_system":"In-Pd-Pr","density":8.300415120545379,"density_atomic":0.041007758862964816,"volume":243.85629152319424,"volume_molar":14.685369127642705,"formula_full":"Pr4 In2 Pd4","formula_reduced":"Pr2InPd2","formula_anonymous":"AB2C2","energy_above_hull":1.160416214,"spacegroup":127},{"id":"jvasp-15270","created_at":"2022-09-04T14:36:00.433944Z","updated_at":"2022-09-04T14:36:00.433972Z","structure_string":"Ce1 Si2 Pd2\n1.0\n3.923392 0.000000 -1.525543\n-0.593181 3.878291 -1.525543\n0.011436 0.013318 5.837273\nCe Si Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.617262 0.617262 0.234524 Si\n0.382738 0.382738 0.765477 Si\n0.750000 0.250000 0.500000 Pd\n0.250001 0.750000 0.500000 Pd\n","nsites":5,"nelements":3,"elements":["Ce","Si","Pd"],"chemical_system":"Ce-Pd-Si","density":7.635127870018828,"density_atomic":0.05619259394972956,"volume":88.9796972973529,"volume_molar":10.716965238137016,"formula_full":"Ce1 Si2 Pd2","formula_reduced":"Ce(SiPd)2","formula_anonymous":"AB2C2","energy_above_hull":2.33978482,"spacegroup":139},{"id":"jvasp-92465","created_at":"2022-09-04T14:36:00.871316Z","updated_at":"2022-09-04T14:36:00.871332Z","structure_string":"Yb2 Te1 O2\n1.0\n3.717047 0.000000 0.000000\n-1.858524 3.217692 0.000245\n0.000000 -0.000469 8.349769\nYb Te O\n2 1 2\ndirect\n0.333239 0.666633 0.345213 Yb\n0.666607 0.333366 0.654787 Yb\n0.000107 0.000000 0.000000 Te\n0.333221 0.666592 0.614966 O\n0.666630 0.333408 0.385033 O\n","nsites":5,"nelements":3,"elements":["Yb","Te","O"],"chemical_system":"O-Te-Yb","density":8.408274053283627,"density_atomic":0.0500671670584454,"volume":99.86584609756932,"volume_molar":12.028123646321182,"formula_full":"Yb2 Te1 O2","formula_reduced":"Yb2TeO2","formula_anonymous":"AB2C2","energy_above_hull":0.3997232333333329,"spacegroup":164},{"id":"jvasp-50346","created_at":"2022-09-04T14:36:07.343178Z","updated_at":"2022-09-04T14:36:07.343199Z","structure_string":"Zr8 N8 O4\n1.0\n5.494018 -0.001864 0.001321\n2.712880 4.842292 -0.003137\n2.670863 1.449495 9.787792\nZr N O\n8 8 4\ndirect\n0.695246 0.687595 0.961049 Zr\n0.829547 0.815557 0.537942 Zr\n0.415181 0.442878 0.712198 Zr\n0.920978 0.952518 0.211934 Zr\n0.087479 0.067579 0.788509 Zr\n0.563786 0.578759 0.286849 Zr\n0.197778 0.169698 0.463516 Zr\n0.322201 0.308814 0.037638 Zr\n0.921575 0.326461 0.120209 N\n0.575582 0.173798 0.369004 N\n0.621497 0.918236 0.124832 N\n0.167357 0.868370 0.376377 N\n0.416572 0.830451 0.621256 N\n0.386528 0.074282 0.874381 N\n0.087353 0.675895 0.873840 N\n0.112371 0.425224 0.628414 N\n0.868458 0.562621 0.381262 O\n0.680307 0.374883 0.875415 O\n0.812611 0.127127 0.626394 O\n0.317596 0.619248 0.128974 O\n","nsites":20,"nelements":3,"elements":["Zr","N","O"],"chemical_system":"N-O-Zr","density":5.775265345374598,"density_atomic":0.076789141538436,"volume":260.45349120082574,"volume_molar":7.84243792722397,"formula_full":"Zr8 N8 O4","formula_reduced":"Zr2N2O","formula_anonymous":"AB2C2","energy_above_hull":4.089577800000001,"spacegroup":1},{"id":"jvasp-15349","created_at":"2022-09-04T14:36:07.125965Z","updated_at":"2022-09-04T14:36:07.125992Z","structure_string":"Sm1 Si2 Pd2\n1.0\n3.930680 0.000000 -1.529589\n-0.595225 3.885351 -1.529589\n-0.003638 -0.004238 5.805905\nSm Si Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.618567 0.618568 0.237136 Si\n0.381431 0.381431 0.762864 Si\n0.749999 0.250000 0.500000 Pd\n0.249999 0.749999 0.500000 Pd\n","nsites":5,"nelements":3,"elements":["Sm","Si","Pd"],"chemical_system":"Pd-Si-Sm","density":7.858312379990466,"density_atomic":0.05642243181420188,"volume":88.61723678385427,"volume_molar":10.673309473492404,"formula_full":"Sm1 Si2 Pd2","formula_reduced":"Sm(SiPd)2","formula_anonymous":"AB2C2","energy_above_hull":2.190705495,"spacegroup":139}]}