{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=4595","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=4593","results":[{"id":"jvasp-120394","created_at":"2022-09-04T14:38:54.199660Z","updated_at":"2022-09-04T14:38:54.199686Z","structure_string":"Sb1 Au1 F2\n1.0\n3.427692 0.000000 -0.000000\n-0.000000 3.427692 -0.000000\n0.000000 0.000000 5.363895\nSb Au F\n1 1 2\ndirect\n0.500000 0.500000 0.564914 Sb\n0.000000 0.000000 0.901778 Au\n0.000000 0.000000 0.371336 F\n0.500000 0.500000 0.171971 F\n","nsites":4,"nelements":3,"elements":["Sb","Au","F"],"chemical_system":"Au-F-Sb","density":9.39932825135109,"density_atomic":0.06347111706393893,"volume":63.02079095237158,"volume_molar":9.488001848042902,"formula_full":"Sb1 Au1 F2","formula_reduced":"SbAuF2","formula_anonymous":"ABC2","energy_above_hull":0.16744605875,"spacegroup":99},{"id":"jvasp-121004","created_at":"2022-09-04T14:38:54.200222Z","updated_at":"2022-09-04T14:38:54.200252Z","structure_string":"H1 O1 F1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nH O F\n1 1 1\ndirect\n0.000000 0.000000 -0.003292 H\n0.000000 0.000000 0.846639 O\n0.000000 0.000000 0.152541 F\n","nsites":3,"nelements":3,"elements":["H","O","F"],"chemical_system":"F-H-O","density":0.39401923671904077,"density_atomic":0.019770506832558536,"volume":151.74117818059824,"volume_molar":30.460224469726775,"formula_full":"H1 O1 F1","formula_reduced":"HOF","formula_anonymous":"ABC","energy_above_hull":1.5593312608333334,"spacegroup":99},{"id":"jvasp-122610","created_at":"2022-09-04T14:38:54.201095Z","updated_at":"2022-09-04T14:38:54.201123Z","structure_string":"Si1 Sn7\n1.0\n6.489066 -0.000000 -0.000000\n-0.000000 6.489066 0.000000\n0.000000 -0.000000 6.489066\nSi Sn\n1 7\ndirect\n0.000000 0.000000 0.500000 Si\n0.238908 0.238908 0.738908 Sn\n0.000000 0.500000 0.000000 Sn\n0.238908 0.761092 0.261092 Sn\n0.500000 0.000000 0.000000 Sn\n0.761092 0.238908 0.261092 Sn\n0.500000 0.500000 0.500000 Sn\n0.761092 0.761092 0.738908 Sn\n","nsites":8,"nelements":2,"elements":["Si","Sn"],"chemical_system":"Si-Sn","density":5.220639993711385,"density_atomic":0.0292781352639314,"volume":273.2414454637566,"volume_molar":20.56873057560757,"formula_full":"Si1 Sn7","formula_reduced":"SiSn7","formula_anonymous":"AB7","energy_above_hull":0.8873638124999998,"spacegroup":215},{"id":"jvasp-122506","created_at":"2022-09-04T14:38:54.202940Z","updated_at":"2022-09-04T14:38:54.202966Z","structure_string":"Li4 Ni4 As4 O16\n1.0\n4.892397 -0.000000 0.000000\n0.000000 5.911706 0.000000\n-0.000000 -0.000000 10.308754\nLi Ni As O\n4 4 4 16\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n-0.000000 0.500000 -0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.993472 0.249999 0.270694 Ni\n0.506529 0.249999 0.770693 Ni\n0.006529 0.750001 0.729305 Ni\n0.493471 0.750001 0.229306 Ni\n0.562403 0.750001 0.906641 As\n0.937597 0.750001 0.406640 As\n0.437598 0.249999 0.093359 As\n0.062403 0.249999 0.593359 As\n0.270461 0.476212 0.169328 O\n0.770462 0.523788 0.330672 O\n0.270461 0.023788 0.169328 O\n0.770462 0.976213 0.330672 O\n0.729539 0.523788 0.830671 O\n0.229539 0.476212 0.669328 O\n0.792070 0.750001 0.559858 O\n0.212832 0.750001 0.905720 O\n0.292070 0.249999 0.940141 O\n0.707931 0.750001 0.059858 O\n0.287168 0.750001 0.405720 O\n0.712835 0.249999 0.594280 O\n0.229539 0.023788 0.669328 O\n0.787167 0.249999 0.094280 O\n0.207930 0.249999 0.440142 O\n0.729539 0.976213 0.830671 O\n","nsites":28,"nelements":4,"elements":["Li","Ni","As","O"],"chemical_system":"As-Li-Ni-O","density":4.556963195856795,"density_atomic":0.09391118840807922,"volume":298.1540376033741,"volume_molar":6.412591366463756,"formula_full":"Li4 Ni4 As4 O16","formula_reduced":"LiNiAsO4","formula_anonymous":"ABCD4","energy_above_hull":2.0273840214285714,"spacegroup":62},{"id":"jvasp-121000","created_at":"2022-09-04T14:38:54.203735Z","updated_at":"2022-09-04T14:38:54.203769Z","structure_string":"Na1 H1 F2\n1.0\n2.809735 -1.669460 -0.098860\n2.809735 1.669460 -0.098860\n-2.596615 0.000000 4.517222\nNa H F\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.999998 0.999998 0.499999 H\n0.205355 0.205355 0.730893 F\n0.794641 0.794641 0.269106 F\n","nsites":4,"nelements":3,"elements":["Na","H","F"],"chemical_system":"F-H-Na","density":2.47932388530688,"density_atomic":0.09633650504942799,"volume":41.52112429185275,"volume_molar":6.251151374974815,"formula_full":"Na1 H1 F2","formula_reduced":"NaHF2","formula_anonymous":"ABC2","energy_above_hull":0.0124174999999999,"spacegroup":12},{"id":"jvasp-121972","created_at":"2022-09-04T14:38:54.208658Z","updated_at":"2022-09-04T14:38:54.208687Z","structure_string":"Pr6 Pd8\n1.0\n7.459435 0.003524 -3.398524\n-5.284024 5.265194 -3.398524\n0.001455 0.003524 8.197142\nPr Pd\n6 8\ndirect\n0.404648 0.027587 0.279478 Pr\n0.027587 0.279478 0.404649 Pr\n0.279478 0.404648 0.027587 Pr\n0.595350 0.972411 0.720521 Pr\n0.972411 0.720520 0.595351 Pr\n0.720521 0.595349 0.972412 Pr\n0.000000 0.000000 0.000000 Pd\n0.499999 0.499999 0.500000 Pd\n0.223167 0.059438 0.554517 Pd\n0.059438 0.554516 0.223168 Pd\n0.554516 0.223167 0.059438 Pd\n0.776831 0.940560 0.445483 Pd\n0.940561 0.445481 0.776832 Pd\n0.445482 0.776831 0.940561 Pd\n","nsites":14,"nelements":2,"elements":["Pr","Pd"],"chemical_system":"Pd-Pr","density":8.742826109860552,"density_atomic":0.04344087988423998,"volume":322.27708180190643,"volume_molar":13.862842502379392,"formula_full":"Pr6 Pd8","formula_reduced":"Pr3Pd4","formula_anonymous":"A3B4","energy_above_hull":1.7912589071428575,"spacegroup":148},{"id":"jvasp-122621","created_at":"2022-09-04T14:38:54.210151Z","updated_at":"2022-09-04T14:38:54.210177Z","structure_string":"U1 Sn7\n1.0\n6.772147 -0.000000 0.000000\n0.000000 6.772147 0.000000\n-0.000000 -0.000000 6.772147\nU Sn\n1 7\ndirect\n0.000000 0.000000 0.500000 U\n0.257318 0.257318 0.757319 Sn\n0.000000 0.500000 0.000000 Sn\n0.257318 0.742682 0.242682 Sn\n0.500000 0.000000 0.000000 Sn\n0.742682 0.257318 0.242682 Sn\n0.500000 0.500000 0.500000 Sn\n0.742682 0.742682 0.757319 Sn\n","nsites":8,"nelements":2,"elements":["U","Sn"],"chemical_system":"Sn-U","density":5.715407891295583,"density_atomic":0.02575792398822278,"volume":310.5840363399557,"volume_molar":23.379759808102104,"formula_full":"U1 Sn7","formula_reduced":"USn7","formula_anonymous":"AB7","energy_above_hull":1.3575422375,"spacegroup":215},{"id":"jvasp-120740","created_at":"2022-09-04T14:38:54.210344Z","updated_at":"2022-09-04T14:38:54.210372Z","structure_string":"Li2 V4 F14\n1.0\n7.168145 -0.202836 1.994732\n3.693368 6.146745 1.994732\n0.042229 0.023109 5.162968\nLi V F\n2 4 14\ndirect\n0.507716 0.492285 0.250000 Li\n0.492285 0.507716 0.750000 Li\n0.660103 0.011765 0.732164 V\n0.011765 0.660103 0.232164 V\n0.339898 0.988235 0.267835 V\n0.988236 0.339898 0.767835 V\n0.148857 0.078032 0.013512 F\n0.078032 0.148857 0.513512 F\n0.578345 0.805570 0.005185 F\n0.805570 0.578344 0.505185 F\n-0.000000 0.500000 -0.000000 F\n0.500001 -0.000000 0.500000 F\n0.851144 0.921968 0.986487 F\n0.421656 0.194430 -0.005186 F\n0.364255 0.720516 0.464531 F\n0.921968 0.851144 0.486487 F\n0.279485 0.635746 0.035468 F\n0.635746 0.279485 0.535468 F\n0.194430 0.421656 0.494814 F\n0.720516 0.364254 0.964531 F\n","nsites":20,"nelements":3,"elements":["Li","V","F"],"chemical_system":"F-Li-V","density":3.481702206863966,"density_atomic":0.086708804658422,"volume":230.65708354286954,"volume_molar":6.9452471219311995,"formula_full":"Li2 V4 F14","formula_reduced":"LiV2F7","formula_anonymous":"AB2C7","energy_above_hull":0.70543603775,"spacegroup":15},{"id":"jvasp-123409","created_at":"2022-09-04T14:38:54.212274Z","updated_at":"2022-09-04T14:38:54.212313Z","structure_string":"Mg1 Zr1\n1.0\n1.522695 -2.637383 -0.000000\n1.522695 2.637383 -0.000000\n0.000000 0.000000 5.489601\nMg Zr\n1 1\ndirect\n0.666665 0.333332 0.250000 Mg\n0.333332 0.666665 0.750000 Zr\n","nsites":2,"nelements":2,"elements":["Mg","Zr"],"chemical_system":"Mg-Zr","density":4.350941178509916,"density_atomic":0.045360005235952607,"volume":44.09170566882537,"volume_molar":13.276322894307816,"formula_full":"Mg1 Zr1","formula_reduced":"MgZr","formula_anonymous":"AB","energy_above_hull":1.302664785714286,"spacegroup":187},{"id":"jvasp-121077","created_at":"2022-09-04T14:38:54.215573Z","updated_at":"2022-09-04T14:38:54.215597Z","structure_string":"H2 C1\n1.0\n3.014047 0.000000 0.000000\n0.000000 1.759130 0.000000\n0.000000 0.000000 3.143523\nH C\n2 1\ndirect\n-0.126700 0.000000 0.730525 H\n-0.126700 0.000000 0.269474 H\n0.653402 0.000000 0.000000 C\n","nsites":3,"nelements":2,"elements":["H","C"],"chemical_system":"C-H","density":1.397450047850202,"density_atomic":0.17999343167324292,"volume":16.667274867263767,"volume_molar":3.345755844542424,"formula_full":"H2 C1","formula_reduced":"H2C","formula_anonymous":"AB2","energy_above_hull":3.61033,"spacegroup":25},{"id":"jvasp-123638","created_at":"2022-09-04T14:38:54.221843Z","updated_at":"2022-09-04T14:38:54.221866Z","structure_string":"Ac1 Se2\n1.0\n3.487126 -4.426803 -0.588187\n2.090163 3.620265 -0.000000\n-1.032006 0.595829 4.001977\nAc Se\n1 2\ndirect\n-0.000000 0.333323 0.166667 Ac\n0.706536 0.686608 0.506091 Se\n0.293463 -0.019930 0.827242 Se\n","nsites":3,"nelements":2,"elements":["Ac","Se"],"chemical_system":"Ac-Se","density":7.5533432426785545,"density_atomic":0.03545201306639655,"volume":84.62142881368764,"volume_molar":16.986738520944897,"formula_full":"Ac1 Se2","formula_reduced":"AcSe2","formula_anonymous":"AB2","energy_above_hull":0.5165989111111111,"spacegroup":12},{"id":"jvasp-123363","created_at":"2022-09-04T14:38:54.243440Z","updated_at":"2022-09-04T14:38:54.243480Z","structure_string":"V1 Ag3\n1.0\n4.113790 -0.000000 0.000000\n-0.000000 4.113790 0.000000\n-0.000000 -0.000000 4.113790\nV Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 V\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n","nsites":4,"nelements":2,"elements":["V","Ag"],"chemical_system":"Ag-V","density":8.933631250803778,"density_atomic":0.05745576836482046,"volume":69.61877134079293,"volume_molar":10.481351013812725,"formula_full":"V1 Ag3","formula_reduced":"VAg3","formula_anonymous":"AB3","energy_above_hull":0.969923995,"spacegroup":221}]}