{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=87","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=85","results":[{"id":"jvasp-94081","created_at":"2022-09-04T14:35:43.504591Z","updated_at":"2022-09-04T14:35:43.504619Z","structure_string":"Mg6 V1 Sn1\n1.0\n6.254189 0.034223 0.000000\n-3.097457 5.433398 0.000000\n0.000000 0.000000 5.016328\nMg V Sn\n6 1 1\ndirect\n0.164079 0.825920 0.250000 Mg\n0.674080 0.335920 0.250000 Mg\n0.665253 0.834747 0.250000 Mg\n0.328686 0.658412 0.750000 Mg\n0.841588 0.171314 0.750000 Mg\n0.830924 0.669075 0.750000 Mg\n0.168121 0.331879 0.250000 V\n0.327267 0.172733 0.750000 Sn\n","nsites":8,"nelements":3,"elements":["Mg","V","Sn"],"chemical_system":"Mg-Sn-V","density":3.063669329545871,"density_atomic":0.04678524211656388,"volume":170.99409211281338,"volume_molar":12.871881147897101,"formula_full":"Mg6 V1 Sn1","formula_reduced":"Mg6VSn","formula_anonymous":"ABC6","energy_above_hull":0.0,"spacegroup":38},{"id":"jvasp-15079","created_at":"2022-09-04T14:35:43.509406Z","updated_at":"2022-09-04T14:35:43.509433Z","structure_string":"Pu2 Ir4\n1.0\n4.577835 -0.000000 2.643014\n1.525945 4.316025 2.643014\n-0.000000 -0.000000 5.286029\nPu Ir\n2 4\ndirect\n0.874998 0.874999 0.875000 Pu\n0.125000 0.125000 0.125000 Pu\n0.499999 0.499999 0.500000 Ir\n0.499999 0.499999 -0.000000 Ir\n-0.000000 0.499999 0.500000 Ir\n0.499999 0.000000 0.500000 Ir\n","nsites":6,"nelements":2,"elements":["Pu","Ir"],"chemical_system":"Ir-Pu","density":19.98320475753841,"density_atomic":0.05744835826549111,"volume":104.44162690031412,"volume_molar":10.482702973284903,"formula_full":"Pu2 Ir4","formula_reduced":"PuIr2","formula_anonymous":"AB2","energy_above_hull":5.030140733333333,"spacegroup":227},{"id":"jvasp-93227","created_at":"2022-09-04T14:35:43.515501Z","updated_at":"2022-09-04T14:35:43.515533Z","structure_string":"K1 Ni2 Se2\n1.0\n3.945988 0.000000 0.000000\n-0.000000 3.945988 -0.000000\n-1.972994 -1.972994 6.433929\nK Ni Se\n1 2 2\ndirect\n0.000000 0.000000 0.000000 K\n0.250001 0.750001 0.500000 Ni\n0.750001 0.250001 0.500000 Ni\n0.645517 0.645517 0.291031 Se\n0.354485 0.354485 0.708969 Se\n","nsites":5,"nelements":3,"elements":["K","Ni","Se"],"chemical_system":"K-Ni-Se","density":5.211357839801438,"density_atomic":0.04990938517355359,"volume":100.18155869107846,"volume_molar":12.066148959877518,"formula_full":"K1 Ni2 Se2","formula_reduced":"K(NiSe)2","formula_anonymous":"AB2C2","energy_above_hull":0.7252379066666667,"spacegroup":139},{"id":"jvasp-5521","created_at":"2022-09-04T14:35:43.518032Z","updated_at":"2022-09-04T14:35:43.518048Z","structure_string":"S2 Cl4 O4\n1.0\n5.379066 0.000000 1.890781\n2.689533 5.037359 0.945390\n0.267928 0.000000 7.834594\nS Cl O\n2 4 4\ndirect\n0.249643 0.500000 0.500000 S\n-0.000357 -0.000000 0.000000 S\n0.377788 0.784618 0.411682 Cl\n0.039471 0.284618 0.088318 Cl\n0.412407 0.715382 0.911682 Cl\n0.574089 0.215382 0.588317 Cl\n-0.000257 0.601571 0.655941 O\n0.905687 0.101571 0.844058 O\n0.257257 0.398429 0.344058 O\n0.851315 0.898429 0.155941 O\n","nsites":10,"nelements":3,"elements":["S","Cl","O"],"chemical_system":"Cl-O-S","density":2.137182728854326,"density_atomic":0.04767887048602504,"volume":209.7365121711736,"volume_molar":12.630627988062605,"formula_full":"S2 Cl4 O4","formula_reduced":"S(ClO)2","formula_anonymous":"AB2C2","energy_above_hull":1.3332830269999998,"spacegroup":43},{"id":"jvasp-65175","created_at":"2022-09-04T14:35:43.518693Z","updated_at":"2022-09-04T14:35:43.518721Z","structure_string":"Be1 Fe1 Pd1\n1.0\n-1.341598 1.341598 4.791230\n1.341598 -1.341598 4.791230\n1.341598 1.341598 -4.791230\nBe Fe Pd\n1 1 1\ndirect\n0.001244 0.001244 0.000000 Be\n0.649101 0.649101 0.000000 Fe\n0.349654 0.349654 0.000000 Pd\n","nsites":3,"nelements":3,"elements":["Be","Fe","Pd"],"chemical_system":"Be-Fe-Pd","density":8.24511640394148,"density_atomic":0.08696999390896047,"volume":34.49465574460517,"volume_molar":6.924389078725164,"formula_full":"Be1 Fe1 Pd1","formula_reduced":"BeFePd","formula_anonymous":"ABC","energy_above_hull":1.9822991,"spacegroup":107},{"id":"jvasp-97428","created_at":"2022-09-04T14:35:43.523210Z","updated_at":"2022-09-04T14:35:43.523242Z","structure_string":"Li4 H16 S4 N4 O16\n1.0\n5.344794 0.000000 0.000000\n0.000000 8.566465 0.000000\n0.000000 0.000000 9.042341\nLi H S N O\n4 16 4 4 16\ndirect\n0.256059 0.808554 0.416062 Li\n0.256059 0.308553 0.083938 Li\n0.756058 0.191447 0.583938 Li\n0.756058 0.691447 0.916062 Li\n0.435809 0.046383 0.776488 H\n0.435809 0.546383 0.723512 H\n0.702009 0.506667 0.163327 H\n0.141846 0.593164 0.678115 H\n0.702009 0.006667 0.336673 H\n0.641846 0.406836 0.321885 H\n0.202009 0.993334 0.663327 H\n0.202009 0.493334 0.836672 H\n0.229050 0.404089 0.669227 H\n0.141846 0.093164 0.821885 H\n0.229050 0.904089 0.830773 H\n0.729049 0.095911 0.169227 H\n0.935809 0.453617 0.276488 H\n0.935809 0.953618 0.223512 H\n0.729049 0.595911 0.330773 H\n0.641846 0.906837 0.178115 H\n0.251083 0.203754 0.420577 S\n0.751082 0.796247 0.579422 S\n0.751082 0.296247 0.920577 S\n0.251083 0.703754 0.079422 S\n0.253047 0.507656 0.727687 N\n0.753046 0.492344 0.272313 N\n0.253047 0.007656 0.772313 N\n0.753046 -0.007656 0.227687 N\n0.647708 0.739965 0.722055 O\n0.147708 0.260035 0.277945 O\n0.011505 0.235316 0.940739 O\n0.091195 0.763182 0.955731 O\n0.754887 0.468681 0.923559 O\n0.754887 0.968681 0.576441 O\n0.147708 0.760036 0.222055 O\n0.011505 0.735317 0.559261 O\n0.254888 0.531320 0.076441 O\n0.091195 0.263182 0.544269 O\n0.591194 0.736819 0.455731 O\n0.511504 0.764684 0.059261 O\n0.254888 0.031320 0.423559 O\n0.647708 0.239965 0.777945 O\n0.591194 0.236819 0.044269 O\n0.511504 0.264684 0.440739 O\n","nsites":44,"nelements":5,"elements":["Li","H","S","N","O"],"chemical_system":"H-Li-N-O-S","density":1.9419225198673855,"density_atomic":0.10627697380618224,"volume":414.01254123252494,"volume_molar":5.66645863569902,"formula_full":"Li4 H16 S4 N4 O16","formula_reduced":"LiH4SNO4","formula_anonymous":"ABCD4E4","energy_above_hull":2.9335306590909083,"spacegroup":33},{"id":"jvasp-86712","created_at":"2022-09-04T14:35:43.530326Z","updated_at":"2022-09-04T14:35:43.530343Z","structure_string":"Ca4 Al4 Au4\n1.0\n4.531999 -0.000000 0.000000\n-0.000000 7.294384 0.000000\n0.000000 0.000000 7.782604\nCa Al Au\n4 4 4\ndirect\n0.250000 0.015419 0.682823 Ca\n0.250000 0.515419 0.817177 Ca\n0.750000 0.984580 0.317177 Ca\n0.750000 0.484580 0.182823 Ca\n0.750000 0.843093 0.930740 Al\n0.250000 0.156907 0.069260 Al\n0.250000 0.656906 0.430740 Al\n0.750000 0.343093 0.569259 Al\n0.250000 0.791137 0.111592 Au\n0.750000 0.208863 0.888407 Au\n0.750000 0.708862 0.611592 Au\n0.250000 0.291137 0.388407 Au\n","nsites":12,"nelements":3,"elements":["Ca","Al","Au"],"chemical_system":"Al-Au-Ca","density":6.816361290009037,"density_atomic":0.046642077421932146,"volume":257.27842032947984,"volume_molar":12.911390514454778,"formula_full":"Ca4 Al4 Au4","formula_reduced":"CaAlAu","formula_anonymous":"ABC","energy_above_hull":0.2344502633333332,"spacegroup":62},{"id":"jvasp-90810","created_at":"2022-09-04T14:35:43.533468Z","updated_at":"2022-09-04T14:35:43.533503Z","structure_string":"Te4 Pb4\n1.0\n0.000000 4.626790 0.000000\n0.000000 -0.000000 4.627536\n13.089301 0.000000 0.000000\nTe Pb\n4 4\ndirect\n0.250000 0.249808 0.875038 Te\n0.250000 0.250193 0.375038 Te\n0.750000 0.750193 0.124962 Te\n0.750000 0.749808 0.624962 Te\n0.250000 0.249672 0.625071 Pb\n0.250000 0.250328 0.125071 Pb\n0.750000 0.750329 0.374929 Pb\n0.750000 0.749673 0.874929 Pb\n","nsites":8,"nelements":2,"elements":["Te","Pb"],"chemical_system":"Pb-Te","density":7.935028464805857,"density_atomic":0.02854591300249782,"volume":280.2502760833043,"volume_molar":21.096332632531503,"formula_full":"Te4 Pb4","formula_reduced":"TePb","formula_anonymous":"AB","energy_above_hull":0.1778892933333333,"spacegroup":225},{"id":"jvasp-14997","created_at":"2022-09-04T14:35:43.538300Z","updated_at":"2022-09-04T14:35:43.538324Z","structure_string":"Yb1 Ni5\n1.0\n2.406037 -4.167378 0.000000\n2.406037 4.167378 0.000000\n0.000000 0.000000 3.941334\nYb Ni\n1 5\ndirect\n0.000000 0.000000 0.000000 Yb\n0.333334 0.666668 0.000000 Ni\n0.666668 0.333334 0.000000 Ni\n0.500000 0.000000 0.500000 Ni\n0.500001 0.500001 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n","nsites":6,"nelements":2,"elements":["Yb","Ni"],"chemical_system":"Ni-Yb","density":9.80096482275509,"density_atomic":0.07591241687713578,"volume":79.0384530861532,"volume_molar":7.933011498957849,"formula_full":"Yb1 Ni5","formula_reduced":"YbNi5","formula_anonymous":"AB5","energy_above_hull":0.8521010666666669,"spacegroup":191},{"id":"jvasp-69309","created_at":"2022-09-04T14:35:43.540361Z","updated_at":"2022-09-04T14:35:43.540388Z","structure_string":"Ba1 Ni1 Cl2\n1.0\n3.795151 -0.000000 0.000000\n0.000000 3.795151 -0.000000\n-0.000000 -0.000000 6.661839\nBa Ni Cl\n1 1 2\ndirect\n0.500000 0.500000 0.773196 Ba\n0.000000 0.000000 0.375444 Ni\n0.000000 0.000000 0.007773 Cl\n0.500000 0.500000 0.343587 Cl\n","nsites":4,"nelements":3,"elements":["Ba","Ni","Cl"],"chemical_system":"Ba-Cl-Ni","density":4.619429822666555,"density_atomic":0.04168768114754245,"volume":95.9516070429311,"volume_molar":14.44585209401846,"formula_full":"Ba1 Ni1 Cl2","formula_reduced":"BaNiCl2","formula_anonymous":"ABC2","energy_above_hull":0.0023716262499999,"spacegroup":99},{"id":"jvasp-69186","created_at":"2022-09-04T14:35:43.541548Z","updated_at":"2022-09-04T14:35:43.541578Z","structure_string":"Ba1 Na2 P1\n1.0\n4.252109 0.000000 0.000000\n0.000000 4.252109 0.000000\n-0.000000 0.000000 6.686664\nBa Na P\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.813826 Na\n0.000000 0.000000 0.186173 Na\n0.500000 0.500000 0.000000 P\n","nsites":4,"nelements":3,"elements":["Ba","Na","P"],"chemical_system":"Ba-Na-P","density":2.943154533994967,"density_atomic":0.033085805539669,"volume":120.89776672368176,"volume_molar":18.201584219491387,"formula_full":"Ba1 Na2 P1","formula_reduced":"BaNa2P","formula_anonymous":"ABC2","energy_above_hull":0.2947948675,"spacegroup":123},{"id":"jvasp-93831","created_at":"2022-09-04T14:35:43.542039Z","updated_at":"2022-09-04T14:35:43.542060Z","structure_string":"Sr2 Mn2 Ge2\n1.0\n4.393288 0.000000 0.000000\n0.000000 4.393288 0.000000\n0.000000 0.000000 7.291392\nSr Mn Ge\n2 2 2\ndirect\n0.000000 0.500000 0.330342 Sr\n0.500000 0.000000 0.669658 Sr\n0.500000 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.813306 Ge\n0.500000 0.000000 0.186694 Ge\n","nsites":6,"nelements":3,"elements":["Sr","Mn","Ge"],"chemical_system":"Ge-Mn-Sr","density":5.078408347780782,"density_atomic":0.04263452753624741,"volume":140.7310071607775,"volume_molar":14.125032240312834,"formula_full":"Sr2 Mn2 Ge2","formula_reduced":"SrMnGe","formula_anonymous":"ABC","energy_above_hull":1.2360898337931034,"spacegroup":129}]}