{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-updated_at&page=4373","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-updated_at&page=4371","results":[{"id":"jvasp-94835","created_at":"2022-09-04T14:35:49.685672Z","updated_at":"2022-09-04T14:35:49.685702Z","structure_string":"Tm1 Fe2 O4\n1.0\n-1.733451 -3.002425 0.000000\n1.733451 -3.002425 0.000000\n0.000000 -2.001616 8.298048\nTm Fe O\n1 2 4\ndirect\n0.000000 0.000000 0.000000 Tm\n0.213296 0.213296 0.360113 Fe\n0.786706 0.786706 0.639887 Fe\n0.126588 0.126588 0.620237 O\n0.873414 0.873414 0.379763 O\n0.292256 0.292256 0.123234 O\n0.707746 0.707746 0.876766 O\n","nsites":7,"nelements":3,"elements":["Tm","Fe","O"],"chemical_system":"Fe-O-Tm","density":6.625248626814769,"density_atomic":0.08104166671901655,"volume":86.3753212809657,"volume_molar":7.430919184917128,"formula_full":"Tm1 Fe2 O4","formula_reduced":"Tm(FeO2)2","formula_anonymous":"AB2C4","energy_above_hull":2.598257035714285,"spacegroup":166},{"id":"jvasp-98477","created_at":"2022-09-04T14:35:49.683364Z","updated_at":"2022-09-04T14:35:49.683391Z","structure_string":"Yb20 Si16\n1.0\n7.434637 -0.000000 0.000000\n-0.000000 7.797421 0.000000\n0.000000 0.000000 15.335237\nYb Si\n20 16\ndirect\n0.817213 0.318878 0.622675 Yb\n0.317212 0.181122 0.622675 Yb\n0.817213 0.318878 0.877325 Yb\n0.182788 0.681122 0.377325 Yb\n0.682788 0.818878 0.122675 Yb\n0.970100 0.820796 0.597413 Yb\n0.470100 0.679204 0.902588 Yb\n0.682788 0.818878 0.377325 Yb\n0.529900 0.320796 0.402588 Yb\n0.029900 0.179204 0.402588 Yb\n0.529900 0.320796 0.097413 Yb\n0.470100 0.679204 0.597413 Yb\n0.970100 0.820796 0.902588 Yb\n0.359423 0.008693 0.250000 Yb\n0.859424 0.491307 0.250000 Yb\n0.029900 0.179204 0.097413 Yb\n0.182788 0.681122 0.122675 Yb\n0.640577 0.991307 0.750000 Yb\n0.317212 0.181122 0.877325 Yb\n0.140577 0.508693 0.750000 Yb\n0.360297 0.974486 0.037055 Si\n0.639703 0.025514 0.537055 Si\n0.139703 0.474486 0.962945 Si\n0.139703 0.474486 0.537055 Si\n0.639703 0.025514 0.962945 Si\n0.360297 0.974486 0.462945 Si\n0.860297 0.525514 0.037055 Si\n0.973556 0.904476 0.250000 Si\n0.526445 0.404476 0.750000 Si\n0.026445 0.095524 0.750000 Si\n0.251148 0.378097 0.250000 Si\n0.751148 0.121903 0.250000 Si\n0.248852 0.878097 0.750000 Si\n0.748853 0.621903 0.750000 Si\n0.473556 0.595524 0.250000 Si\n0.860297 0.525514 0.462945 Si\n","nsites":36,"nelements":2,"elements":["Yb","Si"],"chemical_system":"Si-Yb","density":7.3037057877483385,"density_atomic":0.04049498630727107,"volume":888.9989424082364,"volume_molar":14.871324351870925,"formula_full":"Yb20 Si16","formula_reduced":"Yb5Si4","formula_anonymous":"A4B5","energy_above_hull":1.0747186555555552,"spacegroup":62},{"id":"jvasp-66678","created_at":"2022-09-04T14:35:49.681799Z","updated_at":"2022-09-04T14:35:49.681822Z","structure_string":"Ba1 Na1 Mo1\n1.0\n0.000000 3.883864 3.883864\n3.883864 0.000000 3.883864\n3.883864 3.883864 -0.000000\nBa Na Mo\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.499999 0.499999 0.499999 Na\n0.000000 0.000000 0.000000 Mo\n","nsites":3,"nelements":3,"elements":["Ba","Na","Mo"],"chemical_system":"Ba-Mo-Na","density":3.6316367853689826,"density_atomic":0.025603492910285484,"volume":117.17151290692975,"volume_molar":23.520778126256257,"formula_full":"Ba1 Na1 Mo1","formula_reduced":"BaNaMo","formula_anonymous":"ABC","energy_above_hull":2.0365236233333333,"spacegroup":216},{"id":"jvasp-53075","created_at":"2022-09-04T14:35:49.681236Z","updated_at":"2022-09-04T14:35:49.681247Z","structure_string":"Na2 Nd2 S4\n1.0\n5.709711 0.000258 -0.000080\n-0.000207 5.709713 0.000021\n-2.854690 -2.854800 5.912326\nNa Nd S\n2 2 4\ndirect\n0.249579 0.752793 0.499141 Na\n0.499608 0.502677 -0.000908 Na\n0.999620 0.002743 0.999120 Nd\n0.749591 0.252798 0.499133 Nd\n0.989210 0.492358 0.978317 S\n0.760025 0.763198 0.519950 S\n0.510031 0.013184 0.019939 S\n0.239185 0.242348 0.478293 S\n","nsites":8,"nelements":3,"elements":["Na","Nd","S"],"chemical_system":"Na-Nd-S","density":3.986447765175467,"density_atomic":0.04150547371293059,"volume":192.74566182117047,"volume_molar":14.509268829580583,"formula_full":"Na2 Nd2 S4","formula_reduced":"NaNdS2","formula_anonymous":"ABC2","energy_above_hull":0.694772625,"spacegroup":141},{"id":"jvasp-94230","created_at":"2022-09-04T14:35:49.678894Z","updated_at":"2022-09-04T14:35:49.678928Z","structure_string":"Na1 Mg6 Co1\n1.0\n7.092819 -1.904137 0.000000\n-5.200881 8.959866 0.000000\n0.000000 0.000000 3.205962\nNa Mg Co\n1 6 1\ndirect\n0.249943 0.874970 0.250000 Na\n0.750069 0.375044 0.250000 Mg\n0.750062 0.875029 0.250000 Mg\n0.249625 0.171321 0.749999 Mg\n0.250450 0.578711 0.749999 Mg\n0.842975 0.171300 0.749999 Mg\n0.656942 0.578661 0.749999 Mg\n0.249938 0.374965 0.250000 Co\n","nsites":8,"nelements":3,"elements":["Na","Mg","Co"],"chemical_system":"Co-Mg-Na","density":2.198898242908432,"density_atomic":0.046513817397371274,"volume":171.99190364564916,"volume_molar":12.946993166680706,"formula_full":"Na1 Mg6 Co1","formula_reduced":"NaMg6Co","formula_anonymous":"ABC6","energy_above_hull":0.0,"spacegroup":123},{"id":"jvasp-71436","created_at":"2022-09-04T14:35:49.673646Z","updated_at":"2022-09-04T14:35:49.673661Z","structure_string":"Ca1 Be2 Co1\n1.0\n2.861612 0.000000 -0.000000\n-0.000000 2.861612 -0.000000\n0.000000 0.000000 6.493092\nCa Be Co\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ca\n0.000000 0.000000 0.662131 Be\n0.000000 0.000000 0.337868 Be\n0.500000 0.500000 0.500000 Co\n","nsites":4,"nelements":3,"elements":["Ca","Be","Co"],"chemical_system":"Be-Ca-Co","density":3.655054678149741,"density_atomic":0.07522928570767404,"volume":53.170782659604136,"volume_molar":8.005048437387583,"formula_full":"Ca1 Be2 Co1","formula_reduced":"CaBe2Co","formula_anonymous":"ABC2","energy_above_hull":1.6512233799999998,"spacegroup":123},{"id":"jvasp-68153","created_at":"2022-09-04T14:35:49.673125Z","updated_at":"2022-09-04T14:35:49.673154Z","structure_string":"Be1 Si2 Ni1\n1.0\n2.607525 0.000000 0.000000\n-0.000000 2.607525 -0.000000\n0.000000 0.000000 7.013438\nBe Si Ni\n1 2 1\ndirect\n0.000000 0.000000 0.531299 Be\n0.000000 0.000000 0.952451 Si\n0.499999 0.499999 0.290155 Si\n0.499999 0.499999 0.726096 Ni\n","nsites":4,"nelements":3,"elements":["Be","Si","Ni"],"chemical_system":"Be-Ni-Si","density":4.313704457614852,"density_atomic":0.08388263554050417,"volume":47.68567384925014,"volume_molar":7.179246003890884,"formula_full":"Be1 Si2 Ni1","formula_reduced":"BeSi2Ni","formula_anonymous":"ABC2","energy_above_hull":2.308056425,"spacegroup":99},{"id":"jvasp-18747","created_at":"2022-09-04T14:35:49.672735Z","updated_at":"2022-09-04T14:35:49.672760Z","structure_string":"Mo2 Rh6\n1.0\n2.751338 -4.765456 0.000000\n2.751338 4.765456 -0.000000\n0.000000 -0.000000 4.368295\nMo Rh\n2 6\ndirect\n0.333333 0.666667 0.750001 Mo\n0.666667 0.333333 0.250000 Mo\n0.333809 0.166904 0.750001 Rh\n0.166904 0.833096 0.250000 Rh\n0.166904 0.333809 0.250000 Rh\n0.833096 0.666192 0.750001 Rh\n0.833096 0.166904 0.750001 Rh\n0.666192 0.833096 0.250000 Rh\n","nsites":8,"nelements":2,"elements":["Mo","Rh"],"chemical_system":"Mo-Rh","density":11.732086284551636,"density_atomic":0.06983925876732613,"volume":114.54875296790449,"volume_molar":8.622858928189858,"formula_full":"Mo2 Rh6","formula_reduced":"MoRh3","formula_anonymous":"AB3","energy_above_hull":3.597158725,"spacegroup":194},{"id":"jvasp-69434","created_at":"2022-09-04T14:35:49.670395Z","updated_at":"2022-09-04T14:35:49.670425Z","structure_string":"Be2 Tl1 Se1\n1.0\n-1.751576 1.751576 6.233636\n1.751576 -1.751576 6.233636\n1.751576 1.751576 -6.233636\nBe Tl Se\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.750001 0.250000 0.500001 Tl\n0.500000 0.500000 0.000000 Se\n","nsites":4,"nelements":3,"elements":["Be","Tl","Se"],"chemical_system":"Be-Se-Tl","density":6.541635584251552,"density_atomic":0.05228782647709893,"volume":76.49964187652596,"volume_molar":11.517290286750747,"formula_full":"Be2 Tl1 Se1","formula_reduced":"Be2TlSe","formula_anonymous":"ABC2","energy_above_hull":1.2286795416666665,"spacegroup":119},{"id":"jvasp-87925","created_at":"2022-09-04T14:35:49.670169Z","updated_at":"2022-09-04T14:35:49.670186Z","structure_string":"Sb2 Pb1 O6\n1.0\n5.386182 -0.000000 0.000000\n-2.693091 4.664570 0.000000\n-0.000000 0.000000 5.375631\nSb Pb O\n2 1 6\ndirect\n0.666667 0.333333 0.500000 Sb\n0.333333 0.666667 0.500000 Sb\n0.000000 0.000000 0.000000 Pb\n0.379045 0.379045 0.708350 O\n0.620954 0.000000 0.708350 O\n0.000000 0.620955 0.708350 O\n0.379045 0.000000 0.291650 O\n0.000000 0.379045 0.291650 O\n0.620954 0.620955 0.291650 O\n","nsites":9,"nelements":3,"elements":["Sb","Pb","O"],"chemical_system":"O-Pb-Sb","density":6.721854544292579,"density_atomic":0.06663776470427467,"volume":135.05855185779768,"volume_molar":9.03712900143797,"formula_full":"Sb2 Pb1 O6","formula_reduced":"Sb2PbO6","formula_anonymous":"AB2C6","energy_above_hull":2.188346002222223,"spacegroup":162},{"id":"jvasp-15701","created_at":"2022-09-04T14:35:49.664872Z","updated_at":"2022-09-04T14:35:49.664892Z","structure_string":"Zn1 Rh1\n1.0\n3.022686 0.000000 -0.000000\n0.000000 3.022686 -0.000000\n0.000000 0.000000 3.022686\nZn Rh\n1 1\ndirect\n0.500001 0.500001 0.500001 Zn\n0.000000 0.000000 0.000000 Rh\n","nsites":2,"nelements":2,"elements":["Zn","Rh"],"chemical_system":"Rh-Zn","density":10.120256622607728,"density_atomic":0.07241872795240747,"volume":27.61716556681817,"volume_molar":8.315722921780209,"formula_full":"Zn1 Rh1","formula_reduced":"ZnRh","formula_anonymous":"AB","energy_above_hull":0.6126943333333335,"spacegroup":221},{"id":"jvasp-48957","created_at":"2022-09-04T14:35:49.663619Z","updated_at":"2022-09-04T14:35:49.663646Z","structure_string":"Li7 V1 O4 F2\n1.0\n5.367663 0.027755 -0.015241\n2.618456 4.780062 -0.014155\n2.495210 1.597403 4.933750\nLi V O F\n7 1 4 2\ndirect\n0.470376 0.894896 0.389391 Li\n0.754351 0.481567 0.662919 Li\n0.076703 0.759857 0.652792 Li\n0.374457 0.300523 0.007691 Li\n0.871741 0.222287 0.373290 Li\n0.505908 0.627303 0.102734 Li\n0.459125 0.107142 0.652168 Li\n0.972778 0.983748 0.027606 V\n0.361597 0.748314 0.791037 O\n0.201865 0.925276 0.253189 O\n0.753799 0.094296 0.765459 O\n0.602920 0.207626 0.252793 O\n0.846624 0.607906 0.274360 F\n0.074160 0.378264 0.786556 F\n","nsites":14,"nelements":4,"elements":["Li","V","O","F"],"chemical_system":"F-Li-O-V","density":2.646000750651326,"density_atomic":0.11069920023638781,"volume":126.46884503324601,"volume_molar":5.44009418960596,"formula_full":"Li7 V1 O4 F2","formula_reduced":"Li7V(O2F)2","formula_anonymous":"AB2C4D7","energy_above_hull":1.4705649117857142,"spacegroup":1}]}