{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-id&page=4591","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-id&page=4589","results":[{"id":"jvasp-10076","created_at":"2022-09-04T14:38:08.861661Z","updated_at":"2022-09-04T14:38:08.861684Z","structure_string":"Al4 O6\n1.0\n2.853347 0.000000 -0.703963\n-0.326566 5.503744 -1.323656\n-0.001925 -0.013997 6.126864\nAl O\n4 6\ndirect\n0.909428 0.204363 0.818856 Al\n0.090570 0.795635 0.181143 Al\n0.658024 0.316955 0.316048 Al\n0.341974 0.683044 0.683951 Al\n0.839069 0.890950 0.678142 O\n0.160928 0.109048 0.321856 O\n0.504862 0.742866 0.009725 O\n0.495136 0.257133 0.990274 O\n0.173448 0.566493 0.346899 O\n0.826549 0.433506 0.653100 O\n","nsites":10,"nelements":2,"elements":["Al","O"],"chemical_system":"Al-O","density":3.521682531537758,"density_atomic":0.1040005995741027,"volume":96.15329181708017,"volume_molar":5.79048657859813,"formula_full":"Al4 O6","formula_reduced":"Al2O3","formula_anonymous":"A2B3","energy_above_hull":1.59962522,"spacegroup":12},{"id":"jvasp-100759","created_at":"2022-09-04T14:37:01.371908Z","updated_at":"2022-09-04T14:37:01.371932Z","structure_string":"Ta1 Tc2 Ge1\n1.0\n3.827245 -0.000000 2.209661\n1.275748 3.608361 2.209661\n-0.000000 -0.000000 4.419322\nTa Tc Ge\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.749999 0.750000 0.750000 Tc\n0.250000 0.250000 0.250000 Tc\n0.500000 0.500000 0.500000 Ge\n","nsites":4,"nelements":3,"elements":["Ta","Tc","Ge"],"chemical_system":"Ge-Ta-Tc","density":12.232403593764085,"density_atomic":0.06554025104078368,"volume":61.03119741654519,"volume_molar":9.188461539844587,"formula_full":"Ta1 Tc2 Ge1","formula_reduced":"TaTc2Ge","formula_anonymous":"ABC2","energy_above_hull":4.5360770375,"spacegroup":225},{"id":"jvasp-100758","created_at":"2022-09-04T14:36:40.058378Z","updated_at":"2022-09-04T14:36:40.058414Z","structure_string":"Ta1 P1\n1.0\n3.333348 0.000000 0.000000\n-1.666674 2.886764 0.000000\n0.000000 0.000000 3.343213\nTa P\n1 1\ndirect\n0.666667 0.333333 -0.000000 Ta\n0.000000 0.000000 0.499999 P\n","nsites":2,"nelements":2,"elements":["Ta","P"],"chemical_system":"P-Ta","density":10.938768314848517,"density_atomic":0.062169018637379836,"volume":32.170364658088346,"volume_molar":9.686723213576865,"formula_full":"Ta1 P1","formula_reduced":"TaP","formula_anonymous":"AB","energy_above_hull":2.76687235,"spacegroup":187},{"id":"jvasp-100757","created_at":"2022-09-04T14:36:59.514750Z","updated_at":"2022-09-04T14:36:59.514776Z","structure_string":"Sr2 Br4\n1.0\n7.070457 -0.000000 0.000000\n0.000000 7.070457 0.000000\n-0.000000 -0.000000 4.653333\nSr Br\n2 4\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.303096 0.303096 -0.000000 Br\n0.696904 0.696904 -0.000000 Br\n0.196904 0.803097 0.500000 Br\n0.803097 0.196904 0.500000 Br\n","nsites":6,"nelements":2,"elements":["Sr","Br"],"chemical_system":"Br-Sr","density":3.5323915285976373,"density_atomic":0.025792423264947233,"volume":232.6264553883233,"volume_molar":23.348487647472393,"formula_full":"Sr2 Br4","formula_reduced":"SrBr2","formula_anonymous":"AB2","energy_above_hull":0.0148566666666666,"spacegroup":136},{"id":"jvasp-100756","created_at":"2022-09-04T14:36:39.914385Z","updated_at":"2022-09-04T14:36:39.914406Z","structure_string":"Sr1 Cd3\n1.0\n4.581597 -0.000000 2.645186\n1.527199 4.319571 2.645186\n-0.000000 -0.000000 5.290373\nSr Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Cd\n0.750001 0.750000 0.750000 Cd\n0.500000 0.500000 0.500000 Cd\n","nsites":4,"nelements":2,"elements":["Sr","Cd"],"chemical_system":"Cd-Sr","density":6.738201452156677,"density_atomic":0.03820464737511275,"volume":104.69930426856074,"volume_molar":15.762848694483539,"formula_full":"Sr1 Cd3","formula_reduced":"SrCd3","formula_anonymous":"AB3","energy_above_hull":0.1596645563636363,"spacegroup":225},{"id":"jvasp-100755","created_at":"2022-09-04T14:36:39.603048Z","updated_at":"2022-09-04T14:36:39.603067Z","structure_string":"Sb2 Pb6\n1.0\n6.969925 -0.000000 0.000000\n-3.484962 6.036132 0.000000\n-0.000000 -0.000000 5.857512\nSb Pb\n2 6\ndirect\n0.333333 0.666666 0.750000 Sb\n0.666666 0.333333 0.250000 Sb\n0.168595 0.337190 0.250000 Pb\n0.662809 0.831405 0.250000 Pb\n0.168595 0.831405 0.250000 Pb\n0.831405 0.662809 0.750000 Pb\n0.337190 0.168595 0.750000 Pb\n0.831405 0.168595 0.750000 Pb\n","nsites":8,"nelements":2,"elements":["Sb","Pb"],"chemical_system":"Pb-Sb","density":10.017936185087903,"density_atomic":0.03246309828462405,"volume":246.4336561427087,"volume_molar":18.55072706616038,"formula_full":"Sb2 Pb6","formula_reduced":"SbPb3","formula_anonymous":"AB3","energy_above_hull":0.59933714,"spacegroup":194},{"id":"jvasp-100754","created_at":"2022-09-04T14:36:39.047985Z","updated_at":"2022-09-04T14:36:39.048001Z","structure_string":"Sc2 Co1 Rh1\n1.0\n3.878439 -0.000000 2.239218\n1.292813 3.656627 2.239218\n-0.000000 -0.000000 4.478435\nSc Co Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250001 Sc\n0.750000 0.750001 0.750002 Sc\n0.500000 0.500000 0.500001 Co\n0.000000 0.000000 0.000000 Rh\n","nsites":4,"nelements":3,"elements":["Sc","Co","Rh"],"chemical_system":"Co-Rh-Sc","density":6.581965018630284,"density_atomic":0.06297904765516767,"volume":63.51318651087582,"volume_molar":9.562133732115687,"formula_full":"Sc2 Co1 Rh1","formula_reduced":"Sc2CoRh","formula_anonymous":"ABC2","energy_above_hull":2.6566661,"spacegroup":225},{"id":"jvasp-100753","created_at":"2022-09-04T14:36:39.435263Z","updated_at":"2022-09-04T14:36:39.435272Z","structure_string":"Sc2 Co1 Cu1\n1.0\n3.881159 -0.000000 2.240788\n1.293720 3.659192 2.240788\n-0.000000 -0.000000 4.481577\nSc Co Cu\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sc\n0.750000 0.750000 0.750001 Sc\n0.500000 0.500000 0.500001 Co\n0.000000 0.000000 0.000000 Cu\n","nsites":4,"nelements":3,"elements":["Sc","Co","Cu"],"chemical_system":"Co-Cu-Sc","density":5.541250081669022,"density_atomic":0.06284670255234169,"volume":63.64693512230991,"volume_molar":9.582270056228452,"formula_full":"Sc2 Co1 Cu1","formula_reduced":"Sc2CoCu","formula_anonymous":"ABC2","energy_above_hull":1.9209604625000003,"spacegroup":225},{"id":"jvasp-100752","created_at":"2022-09-04T14:36:39.107851Z","updated_at":"2022-09-04T14:36:39.107869Z","structure_string":"Pr6 Tm2\n1.0\n7.320377 -0.000000 0.000000\n-3.660189 6.339633 0.000000\n-0.000000 -0.000000 5.886310\nPr Tm\n6 2\ndirect\n0.168320 0.336641 0.250000 Pr\n0.663359 0.831679 0.250000 Pr\n0.168320 0.831679 0.250000 Pr\n0.831680 0.663359 0.750000 Pr\n0.336641 0.168320 0.750000 Pr\n0.831680 0.168320 0.750000 Pr\n0.333333 0.666666 0.750000 Tm\n0.666667 0.333333 0.250000 Tm\n","nsites":8,"nelements":2,"elements":["Pr","Tm"],"chemical_system":"Pr-Tm","density":7.1929745243168375,"density_atomic":0.029285273980965264,"volume":273.17483883537545,"volume_molar":20.563716644461817,"formula_full":"Pr6 Tm2","formula_reduced":"Pr3Tm","formula_anonymous":"AB3","energy_above_hull":1.6106959500000002,"spacegroup":194},{"id":"jvasp-100751","created_at":"2022-09-04T14:36:54.975404Z","updated_at":"2022-09-04T14:36:54.975435Z","structure_string":"Pm1 Sm1 In2\n1.0\n4.678527 0.000000 2.701149\n1.559509 4.410958 2.701149\n-0.000000 -0.000000 5.402298\nPm Sm In\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Pm\n0.000000 0.000000 0.000000 Sm\n0.250000 0.250000 0.250000 In\n0.750000 0.750000 0.750000 In\n","nsites":4,"nelements":3,"elements":["Pm","Sm","In"],"chemical_system":"In-Pm-Sm","density":7.81959917817254,"density_atomic":0.03587892247103514,"volume":111.48606826833159,"volume_molar":16.78461989727156,"formula_full":"Pm1 Sm1 In2","formula_reduced":"PmSmIn2","formula_anonymous":"ABC2","energy_above_hull":0.4053074974999998,"spacegroup":225},{"id":"jvasp-100750","created_at":"2022-09-04T14:36:53.894281Z","updated_at":"2022-09-04T14:36:53.894302Z","structure_string":"Pm1 Zr1\n1.0\n3.378397 -0.000000 0.000000\n-1.689199 2.925778 0.000000\n-0.000000 -0.000000 5.552002\nPm Zr\n1 1\ndirect\n0.333334 0.666667 0.500000 Pm\n0.000000 0.000000 0.000000 Zr\n","nsites":2,"nelements":2,"elements":["Pm","Zr"],"chemical_system":"Pm-Zr","density":7.147784493748563,"density_atomic":0.03644419225681947,"volume":54.87842852727127,"volume_molar":16.524281063941356,"formula_full":"Pm1 Zr1","formula_reduced":"PmZr","formula_anonymous":"AB","energy_above_hull":2.0546378375000005,"spacegroup":187},{"id":"jvasp-10075","created_at":"2022-09-04T14:38:13.525105Z","updated_at":"2022-09-04T14:38:13.525146Z","structure_string":"Ca2 Mg2 As2 O8 F2\n1.0\n5.474670 -0.007016 -1.337521\n-1.966809 5.109180 -1.337521\n-0.012334 -0.017940 7.115142\nCa Mg As O F\n2 2 2 8 2\ndirect\n0.167708 0.332292 0.250000 Ca\n0.832293 0.667707 0.750000 Ca\n0.500000 -0.000000 -0.000000 Mg\n0.500000 -0.000000 0.500000 Mg\n0.821166 0.678833 0.250000 As\n0.178834 0.321166 0.750000 As\n0.759716 0.381335 0.073932 O\n0.118664 0.740284 0.426068 O\n0.171143 0.099803 0.881166 O\n0.400197 0.328857 0.618833 O\n0.828857 0.900196 0.118833 O\n0.599803 0.671142 0.381167 O\n0.240284 0.618664 0.926068 O\n0.881336 0.259716 0.573932 O\n0.417973 0.082027 0.250000 F\n0.582027 0.917973 0.750000 F\n","nsites":16,"nelements":5,"elements":["Ca","Mg","As","O","F"],"chemical_system":"As-Ca-F-Mg-O","density":3.7163431797545194,"density_atomic":0.08054082238741084,"volume":198.65702293227298,"volume_molar":7.477128469129349,"formula_full":"Ca2 Mg2 As2 O8 F2","formula_reduced":"CaMgAsO4F","formula_anonymous":"ABCDE4","energy_above_hull":1.1980019378125,"spacegroup":15}]}