{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=created_at&page=4614","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=created_at&page=4612","results":[{"id":"jvasp-123879","created_at":"2022-09-04T14:38:54.725638Z","updated_at":"2022-09-04T14:38:54.725666Z","structure_string":"Co1 Ni1\n1.0\n1.239277 -2.146489 -0.000000\n1.239277 2.146489 -0.000000\n0.000000 0.000000 4.037028\nCo Ni\n1 1\ndirect\n0.666668 0.333334 0.750000 Co\n0.333334 0.666668 0.250000 Ni\n","nsites":2,"nelements":2,"elements":["Co","Ni"],"chemical_system":"Co-Ni","density":9.094227386222512,"density_atomic":0.0931196171107479,"volume":21.477751542098634,"volume_molar":6.467102149741253,"formula_full":"Co1 Ni1","formula_reduced":"CoNi","formula_anonymous":"AB","energy_above_hull":null,"spacegroup":187},{"id":"jvasp-120845","created_at":"2022-09-04T14:38:54.728162Z","updated_at":"2022-09-04T14:38:54.728192Z","structure_string":"B2 Se1\n1.0\n4.893383 -0.318061 -0.756559\n1.359637 -3.736193 -0.003996\n2.336231 0.483470 -2.612279\nB Se\n2 1\ndirect\n0.901096 0.560135 0.520626 B\n0.456719 0.450272 0.059954 B\n0.877663 0.914005 0.001138 Se\n","nsites":3,"nelements":2,"elements":["B","Se"],"chemical_system":"B-Se","density":4.223974951156359,"density_atomic":0.07587054860124574,"volume":39.541034766562134,"volume_molar":7.9373892386763645,"formula_full":"B2 Se1","formula_reduced":"B2Se","formula_anonymous":"AB2","energy_above_hull":3.2161695111111106,"spacegroup":1},{"id":"jvasp-122028","created_at":"2022-09-04T14:38:54.728994Z","updated_at":"2022-09-04T14:38:54.729012Z","structure_string":"La6 Al2 O12\n1.0\n7.527890 -0.004024 0.000000\n-1.683141 7.337314 0.000000\n-0.000000 -0.000000 5.650887\nLa Al O\n6 2 12\ndirect\n0.085197 0.300370 0.468124 La\n0.300370 0.085197 0.968125 La\n0.606144 0.393856 0.432541 La\n0.393856 0.606144 0.932541 La\n0.699630 0.914803 0.468124 La\n0.914803 0.699630 0.968125 La\n0.807187 0.192813 0.007325 Al\n0.192813 0.807187 0.507325 Al\n0.405865 0.889655 0.658900 O\n0.889656 0.405866 0.158900 O\n0.049957 0.950042 0.618507 O\n0.213147 0.786853 0.194378 O\n0.786853 0.213147 0.694378 O\n0.352176 0.329704 0.703576 O\n0.594135 0.110345 0.158900 O\n0.110344 0.594134 0.658900 O\n0.647825 0.670296 0.203576 O\n0.329704 0.352175 0.203576 O\n0.950043 0.049958 0.118507 O\n0.670296 0.647824 0.703576 O\n","nsites":20,"nelements":3,"elements":["La","Al","O"],"chemical_system":"Al-La-O","density":5.7431905859391295,"density_atomic":0.06408498110403338,"volume":312.08560345102825,"volume_molar":9.39711716575817,"formula_full":"La6 Al2 O12","formula_reduced":"La3AlO6","formula_anonymous":"AB3C6","energy_above_hull":2.24727288,"spacegroup":36},{"id":"jvasp-123721","created_at":"2022-09-04T14:38:54.730226Z","updated_at":"2022-09-04T14:38:54.730258Z","structure_string":"V1 Se2\n1.0\n1.682498 -2.915919 -0.063150\n1.684011 2.916792 -0.000000\n0.116414 -0.067212 6.193382\nV Se\n1 2\ndirect\n-0.000000 0.333345 0.166667 V\n0.666496 0.666574 0.419953 Se\n0.333503 0.000078 0.913380 Se\n","nsites":3,"nelements":2,"elements":["V","Se"],"chemical_system":"Se-V","density":5.701055321842825,"density_atomic":0.04931386249818544,"volume":60.83482104267109,"volume_molar":12.211861847612507,"formula_full":"V1 Se2","formula_reduced":"VSe2","formula_anonymous":"AB2","energy_above_hull":null,"spacegroup":164},{"id":"jvasp-122608","created_at":"2022-09-04T14:38:54.730980Z","updated_at":"2022-09-04T14:38:54.731012Z","structure_string":"Sc1 Sn7\n1.0\n6.662105 0.000000 0.000000\n0.000000 6.662105 0.000000\n0.000000 0.000000 6.662105\nSc Sn\n1 7\ndirect\n0.000000 0.000000 0.500000 Sc\n0.250209 0.250209 0.750209 Sn\n0.000000 0.500000 0.000000 Sn\n0.250209 0.749790 0.249790 Sn\n0.500000 0.000000 0.000000 Sn\n0.749790 0.250209 0.249790 Sn\n0.500000 0.500000 0.500000 Sn\n0.749790 0.749790 0.750209 Sn\n","nsites":8,"nelements":2,"elements":["Sc","Sn"],"chemical_system":"Sc-Sn","density":4.919059228716551,"density_atomic":0.027055500184673405,"volume":295.68849015520686,"volume_molar":22.258471360331622,"formula_full":"Sc1 Sn7","formula_reduced":"ScSn7","formula_anonymous":"AB7","energy_above_hull":0.8181683937500001,"spacegroup":215},{"id":"jvasp-122923","created_at":"2022-09-04T14:38:54.735523Z","updated_at":"2022-09-04T14:38:54.735543Z","structure_string":"Ba1 V1\n1.0\n3.811784 0.000000 0.000000\n0.000000 3.811784 0.000000\n-0.000000 -0.000000 3.811784\nBa V\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.499999 0.499999 0.499999 V\n","nsites":2,"nelements":2,"elements":["Ba","V"],"chemical_system":"Ba-V","density":5.644713598804507,"density_atomic":0.036111468305780575,"volume":55.38406755063593,"volume_molar":16.6765325325639,"formula_full":"Ba1 V1","formula_reduced":"BaV","formula_anonymous":"AB","energy_above_hull":null,"spacegroup":221},{"id":"jvasp-122863","created_at":"2022-09-04T14:38:54.736294Z","updated_at":"2022-09-04T14:38:54.736323Z","structure_string":"K1 Sm3\n1.0\n1.816959 -3.147064 0.000000\n1.816959 3.147064 -0.000000\n0.000000 -0.000000 12.890202\nK Sm\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.000000 0.500000 Sm\n0.333334 0.666667 0.279242 Sm\n0.666667 0.333334 0.720758 Sm\n","nsites":4,"nelements":2,"elements":["K","Sm"],"chemical_system":"K-Sm","density":5.521572226570076,"density_atomic":0.02713435921288452,"volume":147.41457384778167,"volume_molar":22.193782844668902,"formula_full":"K1 Sm3","formula_reduced":"KSm3","formula_anonymous":"AB3","energy_above_hull":1.0135434166666668,"spacegroup":164},{"id":"jvasp-121305","created_at":"2022-09-04T14:38:54.740443Z","updated_at":"2022-09-04T14:38:54.740474Z","structure_string":"Li1 Au1 O1\n1.0\n4.005576 -0.000000 0.000000\n-2.002788 3.468931 -0.000000\n-0.000000 0.000000 3.096186\nLi Au O\n1 1 1\ndirect\n0.333332 0.666667 0.000000 Li\n0.000000 0.000000 0.000000 Au\n0.666666 0.333333 0.000000 O\n","nsites":3,"nelements":3,"elements":["Li","Au","O"],"chemical_system":"Au-Li-O","density":8.487903040560454,"density_atomic":0.06973223329518687,"volume":43.02171116907379,"volume_molar":8.636093346540884,"formula_full":"Li1 Au1 O1","formula_reduced":"LiAuO","formula_anonymous":"ABC","energy_above_hull":null,"spacegroup":187},{"id":"jvasp-122047","created_at":"2022-09-04T14:38:54.742183Z","updated_at":"2022-09-04T14:38:54.742215Z","structure_string":"Ga12 Rh4\n1.0\n6.547975 -0.000000 0.000000\n0.000000 6.547975 0.000000\n-0.000000 -0.000000 6.683585\nGa Rh\n12 4\ndirect\n-0.000000 0.500000 0.500000 Ga\n0.500000 0.000000 -0.000000 Ga\n0.500000 0.000000 0.500000 Ga\n-0.000000 0.500000 -0.000000 Ga\n0.355642 0.644358 0.247897 Ga\n0.644358 0.355642 0.247897 Ga\n0.144358 0.144358 0.747897 Ga\n0.855641 0.855641 0.747897 Ga\n0.644358 0.355642 0.752102 Ga\n0.355642 0.644358 0.752102 Ga\n0.855641 0.855641 0.252103 Ga\n0.144358 0.144358 0.252103 Ga\n0.160947 0.839053 0.500000 Rh\n0.839053 0.160947 0.500000 Rh\n0.339053 0.339053 -0.000000 Rh\n0.660946 0.660946 -0.000000 Rh\n","nsites":16,"nelements":2,"elements":["Ga","Rh"],"chemical_system":"Ga-Rh","density":7.233423141848005,"density_atomic":0.05583370938914109,"volume":286.56523406828825,"volume_molar":10.785851103009872,"formula_full":"Ga12 Rh4","formula_reduced":"Ga3Rh","formula_anonymous":"AB3","energy_above_hull":0.29282499375,"spacegroup":136},{"id":"jvasp-120953","created_at":"2022-09-04T14:38:54.742833Z","updated_at":"2022-09-04T14:38:54.742862Z","structure_string":"Ca1 Ta1 O1\n1.0\n3.050187 0.000000 -0.000000\n0.000000 3.050187 0.000000\n0.000000 -0.000000 7.209156\nCa Ta O\n1 1 1\ndirect\n0.000000 0.000000 0.020518 Ca\n0.000000 0.000000 0.563821 Ta\n0.000000 0.000000 0.315119 O\n","nsites":3,"nelements":3,"elements":["Ca","Ta","O"],"chemical_system":"Ca-O-Ta","density":5.868220319160943,"density_atomic":0.044728455274760326,"volume":67.07139742634618,"volume_molar":13.463779875711948,"formula_full":"Ca1 Ta1 O1","formula_reduced":"CaTaO","formula_anonymous":"ABC","energy_above_hull":2.352314373333333,"spacegroup":99},{"id":"jvasp-122609","created_at":"2022-09-04T14:38:54.743086Z","updated_at":"2022-09-04T14:38:54.743113Z","structure_string":"Sn7 Se1\n1.0\n6.652564 0.000000 0.000000\n-0.000000 6.652564 0.000000\n-0.000000 -0.000000 6.652564\nSn Se\n7 1\ndirect\n0.250400 0.250400 0.750399 Sn\n0.000000 0.500000 0.000000 Sn\n0.250400 0.749600 0.249600 Sn\n0.500000 0.000000 0.000000 Sn\n0.749600 0.250400 0.249600 Sn\n0.500000 0.500000 0.500000 Sn\n0.749600 0.749600 0.750399 Sn\n0.000000 0.000000 0.500000 Se\n","nsites":8,"nelements":2,"elements":["Sn","Se"],"chemical_system":"Se-Sn","density":5.132038400277604,"density_atomic":0.027172074900598822,"volume":294.41991564007117,"volume_molar":22.162977181647925,"formula_full":"Sn7 Se1","formula_reduced":"Sn7Se","formula_anonymous":"AB7","energy_above_hull":0.6284994083333334,"spacegroup":215},{"id":"jvasp-123733","created_at":"2022-09-04T14:38:54.744690Z","updated_at":"2022-09-04T14:38:54.744716Z","structure_string":"Hf1 C1\n1.0\n1.614701 -2.796744 0.000000\n1.614701 2.796744 0.000000\n0.000000 -0.000000 2.910437\nHf C\n1 1\ndirect\n0.333333 0.666666 0.750001 Hf\n0.666666 0.333333 0.250000 C\n","nsites":2,"nelements":2,"elements":["Hf","C"],"chemical_system":"C-Hf","density":12.034073106407675,"density_atomic":0.07608463610680892,"volume":26.286515942487593,"volume_molar":7.915054954782218,"formula_full":"Hf1 C1","formula_reduced":"HfC","formula_anonymous":"AB","energy_above_hull":null,"spacegroup":187}]}