{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=3592","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=3590","results":[{"id":"jvasp-12901","created_at":"2022-09-04T14:38:14.287566Z","updated_at":"2022-09-04T14:38:14.287591Z","structure_string":"Zr6 C1 I12\n1.0\n8.687586 -0.007760 -2.684217\n-3.636678 7.889793 -2.684208\n-0.004969 -0.007767 9.092807\nZr C I\n6 1 12\ndirect\n0.971961 0.910534 0.727401 Zr\n0.910535 0.727401 0.971960 Zr\n0.727401 0.971960 0.910534 Zr\n0.028039 0.089465 0.272598 Zr\n0.089465 0.272598 0.028039 Zr\n0.272598 0.028039 0.089465 Zr\n0.000000 0.000000 0.000000 C\n0.079742 0.229916 0.688755 I\n0.311244 0.920257 0.770084 I\n0.770084 0.311244 0.920257 I\n0.920258 0.770084 0.311244 I\n0.451363 0.376114 0.147665 I\n0.548636 0.623886 0.852335 I\n0.852335 0.548636 0.623886 I\n0.229916 0.688755 0.079742 I\n0.376114 0.147665 0.451363 I\n0.147665 0.451363 0.376114 I\n0.623886 0.852334 0.548636 I\n0.688755 0.079742 0.229916 I\n","nsites":19,"nelements":3,"elements":["Zr","C","I"],"chemical_system":"C-I-Zr","density":5.553183748382991,"density_atomic":0.030515631783455895,"volume":622.6317100306894,"volume_molar":19.734609470759555,"formula_full":"Zr6 C1 I12","formula_reduced":"Zr6CI12","formula_anonymous":"AB6C12","energy_above_hull":1.8099232789473687,"spacegroup":148},{"id":"jvasp-37746","created_at":"2022-09-04T14:38:14.290877Z","updated_at":"2022-09-04T14:38:14.290893Z","structure_string":"Pm2 Pt1 Au1\n1.0\n0.000000 3.620920 3.620920\n3.620920 0.000000 3.620920\n3.620920 3.620920 0.000000\nPm Pt Au\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500000 0.500000 0.500000 Pm\n0.750000 0.750000 0.750000 Pt\n0.250000 0.250000 0.250000 Au\n","nsites":4,"nelements":3,"elements":["Pm","Pt","Au"],"chemical_system":"Au-Pm-Pt","density":11.928309203397816,"density_atomic":0.04212822939613405,"volume":94.94821067336537,"volume_molar":14.294787239628516,"formula_full":"Pm2 Pt1 Au1","formula_reduced":"Pm2PtAu","formula_anonymous":"ABC2","energy_above_hull":1.3037903299999998,"spacegroup":225},{"id":"jvasp-57312","created_at":"2022-09-04T14:38:14.294938Z","updated_at":"2022-09-04T14:38:14.294958Z","structure_string":"Na4 Ga2 Ni2 F14\n1.0\n6.229914 -0.000000 3.535107\n2.145124 6.029702 3.476688\n-0.014883 -0.005197 7.283267\nNa Ga Ni F\n4 2 2 14\ndirect\n0.499999 0.500000 0.000001 Na\n0.000000 0.000000 0.000000 Na\n-0.000000 0.500000 0.000000 Na\n0.500000 0.500000 0.500001 Na\n0.500000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500001 Ga\n0.000000 -0.000000 0.500000 Ni\n0.500000 -0.000000 0.500001 Ni\n0.814955 0.945906 0.822643 F\n0.410727 0.318638 0.859909 F\n0.416496 0.945906 0.822643 F\n0.250000 0.888019 0.611981 F\n0.685044 0.677358 0.554095 F\n0.583503 0.054094 0.177359 F\n0.185044 0.054094 0.177359 F\n0.910727 0.359907 0.818640 F\n0.083503 0.677358 0.554094 F\n0.916496 0.322641 0.445907 F\n0.589272 0.681361 0.140093 F\n0.750000 0.111980 0.388021 F\n0.314956 0.322641 0.445907 F\n0.089273 0.640092 0.181362 F\n","nsites":22,"nelements":4,"elements":["Na","Ga","Ni","F"],"chemical_system":"F-Ga-Na-Ni","density":3.7259586608892823,"density_atomic":0.08029699392202296,"volume":273.9828594500608,"volume_molar":7.499833388343466,"formula_full":"Na4 Ga2 Ni2 F14","formula_reduced":"Na2GaNiF7","formula_anonymous":"ABC2D7","energy_above_hull":0.0,"spacegroup":74},{"id":"jvasp-46444","created_at":"2022-09-04T14:38:14.297482Z","updated_at":"2022-09-04T14:38:14.297507Z","structure_string":"Li2 Cr1 Co1 O4\n1.0\n5.070887 -0.137450 0.000000\n2.095681 4.619622 -0.000000\n-3.583285 -2.241085 2.805423\nLi Cr Co O\n2 1 1 4\ndirect\n0.250000 0.750000 0.499999 Li\n0.500000 0.500000 0.000000 Li\n0.750000 0.250000 0.499999 Cr\n0.000000 0.000000 0.000000 Co\n0.519086 0.019086 0.499999 O\n0.230644 0.230644 0.000000 O\n0.980915 0.480915 0.499999 O\n0.769357 0.769356 0.000000 O\n","nsites":8,"nelements":4,"elements":["Li","Cr","Co","O"],"chemical_system":"Co-Cr-Li-O","density":4.712757678697731,"density_atomic":0.12025234348708591,"volume":66.52677002389673,"volume_molar":5.0079196674006825,"formula_full":"Li2 Cr1 Co1 O4","formula_reduced":"Li2CrCoO4","formula_anonymous":"ABC2D4","energy_above_hull":2.5463277875,"spacegroup":119},{"id":"jvasp-12701","created_at":"2022-09-04T14:38:14.297972Z","updated_at":"2022-09-04T14:38:14.297995Z","structure_string":"Li4 Mn2 P2 O8 F2\n1.0\n5.354030 -0.071173 -0.067175\n-0.488859 5.434052 0.038918\n-2.322773 -2.436921 6.627417\nLi Mn P O F\n4 2 2 8 2\ndirect\n0.136068 0.534741 0.097724 Li\n0.523179 0.191508 0.862006 Li\n0.501560 0.904771 0.477216 Li\n0.747909 0.428968 0.666844 Li\n0.000874 0.996600 0.016770 Mn\n0.008098 0.000493 0.501074 Mn\n0.659204 0.365347 0.259678 P\n0.345860 0.651176 0.781827 P\n0.368837 0.274562 0.093380 O\n0.698816 0.651047 0.398725 O\n0.623927 0.762574 0.953172 O\n0.855825 0.336936 0.143826 O\n0.705775 0.195302 0.397550 O\n0.345157 0.363929 0.660144 O\n0.307098 0.831905 0.651298 O\n0.107966 0.647194 0.860480 O\n0.819538 0.118751 0.746872 F\n0.172197 0.875837 0.272837 F\n","nsites":18,"nelements":5,"elements":["Li","Mn","P","O","F"],"chemical_system":"F-Li-Mn-O-P","density":3.1588993813751394,"density_atomic":0.09366497528702429,"volume":192.17428867985404,"volume_molar":6.429447871571977,"formula_full":"Li4 Mn2 P2 O8 F2","formula_reduced":"Li2MnPO4F","formula_anonymous":"ABCD2E4","energy_above_hull":2.114688558208812,"spacegroup":1},{"id":"jvasp-17778","created_at":"2022-09-04T14:38:14.298458Z","updated_at":"2022-09-04T14:38:14.298476Z","structure_string":"Dy2 Ti2 Ge2\n1.0\n4.040094 0.000000 0.000000\n0.000000 4.040094 0.000000\n0.000000 0.000000 7.641731\nDy Ti Ge\n2 2 2\ndirect\n0.499999 0.000000 0.343627 Dy\n0.000000 0.499999 0.656373 Dy\n0.000000 0.000000 0.000000 Ti\n0.499999 0.499999 0.000000 Ti\n0.000000 0.499999 0.245790 Ge\n0.499999 0.000000 0.754210 Ge\n","nsites":6,"nelements":3,"elements":["Dy","Ti","Ge"],"chemical_system":"Dy-Ge-Ti","density":7.535318007181754,"density_atomic":0.048103487609451136,"volume":124.73108080465146,"volume_molar":12.519135429209085,"formula_full":"Dy2 Ti2 Ge2","formula_reduced":"DyTiGe","formula_anonymous":"ABC","energy_above_hull":1.554873594444444,"spacegroup":129},{"id":"jvasp-17624","created_at":"2022-09-04T14:38:14.300579Z","updated_at":"2022-09-04T14:38:14.300608Z","structure_string":"Pu1 Fe2 Si2\n1.0\n3.714261 -0.000000 -1.373810\n-0.508137 3.679338 -1.373810\n-0.057091 -0.065517 5.553529\nPu Fe Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Pu\n0.250000 0.750000 0.500000 Fe\n0.750000 0.250000 0.500000 Fe\n0.633057 0.633058 0.266115 Si\n0.366942 0.366942 0.733885 Si\n","nsites":5,"nelements":3,"elements":["Pu","Fe","Si"],"chemical_system":"Fe-Pu-Si","density":9.091419203470906,"density_atomic":0.06646636385866743,"volume":75.22601974484247,"volume_molar":9.060433594359614,"formula_full":"Pu1 Fe2 Si2","formula_reduced":"Pu(FeSi)2","formula_anonymous":"AB2C2","energy_above_hull":4.38165764,"spacegroup":139},{"id":"jvasp-18060","created_at":"2022-09-04T14:38:14.306193Z","updated_at":"2022-09-04T14:38:14.306220Z","structure_string":"Ce2 P2 Ru2 O2\n1.0\n4.021147 0.000000 0.000000\n0.000000 4.021147 0.000000\n0.000000 0.000000 7.956631\nCe P Ru O\n2 2 2 2\ndirect\n0.500000 0.000000 0.848235 Ce\n0.000000 0.500000 0.151765 Ce\n0.000000 0.500000 0.649853 P\n0.500000 0.000000 0.350147 P\n0.500000 0.500000 0.500000 Ru\n0.000000 0.000000 0.500000 Ru\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n","nsites":8,"nelements":4,"elements":["Ce","P","Ru","O"],"chemical_system":"Ce-O-P-Ru","density":7.4384493226907535,"density_atomic":0.062181453557740025,"volume":128.65572517650162,"volume_molar":9.684786082409607,"formula_full":"Ce2 P2 Ru2 O2","formula_reduced":"CePRuO","formula_anonymous":"ABCD","energy_above_hull":2.4794637500000007,"spacegroup":129},{"id":"jvasp-12805","created_at":"2022-09-04T14:38:14.307683Z","updated_at":"2022-09-04T14:38:14.307721Z","structure_string":"Li12 B4 O12\n1.0\n3.236434 -0.005135 0.000000\n-1.592621 8.183737 0.000000\n0.000000 0.000000 9.171824\nLi B O\n12 4 12\ndirect\n0.506536 0.982890 0.768524 Li\n0.493464 0.517112 0.268525 Li\n0.493464 0.017111 0.231475 Li\n0.506536 0.482889 0.731475 Li\n0.723698 0.888174 0.523639 Li\n0.276301 0.611827 0.023639 Li\n0.276301 0.111827 0.476360 Li\n0.723698 0.388174 0.976360 Li\n0.091578 0.631987 0.572425 Li\n0.908422 0.868014 0.072425 Li\n0.908422 0.368015 0.427574 Li\n0.091578 0.131987 0.927574 Li\n0.801116 0.245101 0.686800 B\n0.198884 0.254900 0.186800 B\n0.198884 0.754900 0.313200 B\n0.801116 0.745101 0.813200 B\n0.969827 0.900776 0.862392 O\n0.030173 0.599225 0.362393 O\n0.030172 0.099225 0.137607 O\n0.969827 0.400776 0.637607 O\n0.772464 0.611062 0.905556 O\n0.227536 0.888939 0.405556 O\n0.227536 0.388939 0.094444 O\n0.772464 0.111062 0.594443 O\n0.636198 0.720606 0.672170 O\n0.363802 0.779395 0.172170 O\n0.363802 0.279395 0.327830 O\n0.636198 0.220606 0.827829 O\n","nsites":28,"nelements":3,"elements":["Li","B","O"],"chemical_system":"B-Li-O","density":2.1779995675437354,"density_atomic":0.11529700275579642,"volume":242.85106577579558,"volume_molar":5.223154649349498,"formula_full":"Li12 B4 O12","formula_reduced":"Li3BO3","formula_anonymous":"AB3C3","energy_above_hull":1.8977304404761908,"spacegroup":14},{"id":"jvasp-12549","created_at":"2022-09-04T14:38:14.311089Z","updated_at":"2022-09-04T14:38:14.311112Z","structure_string":"Ba1 Ta2 Bi2 O9\n1.0\n3.922980 0.000000 -0.596794\n-0.090789 3.921929 -0.596794\n-0.064207 -0.065710 12.770041\nBa Ta Bi O\n1 2 2 9\ndirect\n0.000000 0.000000 0.000000 Ba\n0.410966 0.410967 0.821934 Ta\n0.589033 0.589033 0.178067 Ta\n0.200826 0.200827 0.401654 Bi\n0.799172 0.799173 0.598347 Bi\n0.581810 0.081811 0.163621 O\n0.081810 0.581811 0.163621 O\n0.418188 0.918190 0.836380 O\n0.918189 0.418190 0.836380 O\n0.249999 0.750000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.335387 0.335387 0.670776 O\n0.664612 0.664613 0.329225 O\n0.749999 0.250000 0.500000 O\n","nsites":14,"nelements":4,"elements":["Ba","Ta","Bi","O"],"chemical_system":"Ba-Bi-O-Ta","density":8.982762805754971,"density_atomic":0.0713675136963811,"volume":196.16768575629825,"volume_molar":8.43821011562768,"formula_full":"Ba1 Ta2 Bi2 O9","formula_reduced":"BaTa2Bi2O9","formula_anonymous":"AB2C2D9","energy_above_hull":3.0557453192857142,"spacegroup":139},{"id":"jvasp-22498","created_at":"2022-09-04T14:38:14.315593Z","updated_at":"2022-09-04T14:38:14.315602Z","structure_string":"Mg1 Sn1 F6\n1.0\n4.586515 0.083231 3.041390\n1.675389 4.270377 3.041390\n0.119713 0.083231 5.501985\nMg Sn F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Sn\n0.384044 0.116783 0.748900 F\n0.116783 0.748900 0.384044 F\n0.251100 0.615956 0.883218 F\n0.883218 0.251100 0.615956 F\n0.615956 0.883218 0.251100 F\n0.748900 0.384044 0.116782 F\n","nsites":8,"nelements":3,"elements":["Mg","Sn","F"],"chemical_system":"F-Mg-Sn","density":4.074773876555802,"density_atomic":0.07638395154360234,"volume":104.73404214278376,"volume_molar":7.884039301845197,"formula_full":"Mg1 Sn1 F6","formula_reduced":"MgSnF6","formula_anonymous":"ABC6","energy_above_hull":0.0,"spacegroup":148},{"id":"jvasp-108177","created_at":"2022-09-04T14:38:14.318162Z","updated_at":"2022-09-04T14:38:14.318194Z","structure_string":"Ti1 Al1 F5\n1.0\n5.038903 0.002153 -1.529796\n-0.892720 3.263340 -4.035404\n-0.024061 -0.002153 5.265951\nTi Al F\n1 1 5\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 -0.000000 Al\n0.795722 0.500000 0.295722 F\n0.204277 0.500000 0.704278 F\n0.266560 0.266560 -0.000000 F\n0.733439 0.733439 -0.000001 F\n0.500000 -0.000000 0.500000 F\n","nsites":7,"nelements":3,"elements":["Ti","Al","F"],"chemical_system":"Al-F-Ti","density":3.262879422362048,"density_atomic":0.0809857424936455,"volume":86.43496724808384,"volume_molar":7.436050562199296,"formula_full":"Ti1 Al1 F5","formula_reduced":"TiAlF5","formula_anonymous":"ABC5","energy_above_hull":0.2990846494047617,"spacegroup":71}]}