{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_reduced&page=3461","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_reduced&page=3459","results":[{"id":"jvasp-51128","created_at":"2022-09-04T14:36:59.812947Z","updated_at":"2022-09-04T14:36:59.812966Z","structure_string":"Sc1 Hg1 W2\n1.0\n-0.000000 3.300068 3.300068\n3.300068 -0.000000 3.300068\n3.300068 3.300068 -0.000000\nSc Hg W\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 Hg\n0.750000 0.750000 0.750000 W\n0.250000 0.250000 0.250000 W\n","nsites":4,"nelements":3,"elements":["Sc","Hg","W"],"chemical_system":"Hg-Sc-W","density":14.166772929824734,"density_atomic":0.05564950799264005,"volume":71.87844321155583,"volume_molar":10.821552565741392,"formula_full":"Sc1 Hg1 W2","formula_reduced":"ScHgW2","formula_anonymous":"ABC2","energy_above_hull":4.418602462499999,"spacegroup":225},{"id":"jvasp-118484","created_at":"2022-09-04T14:38:34.013896Z","updated_at":"2022-09-04T14:38:34.013919Z","structure_string":"Sc1 H1 O1\n1.0\n3.586269 -0.000000 0.000000\n-1.793134 3.105800 -0.000000\n0.000000 -0.000000 4.177577\nSc H O\n1 1 1\ndirect\n0.666666 0.333333 0.000000 Sc\n0.000000 0.000000 0.000000 H\n0.333334 0.666666 0.000000 O\n","nsites":3,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":2.211273640295178,"density_atomic":0.06447338073219804,"volume":46.53083126602354,"volume_molar":9.340507185460092,"formula_full":"Sc1 H1 O1","formula_reduced":"ScHO","formula_anonymous":"ABC","energy_above_hull":1.7882762499999998,"spacegroup":187},{"id":"jvasp-118482","created_at":"2022-09-04T14:38:34.001857Z","updated_at":"2022-09-04T14:38:34.001898Z","structure_string":"Sc2 H2 O2\n1.0\n1.750303 1.010538 5.731377\n-1.750303 1.010538 5.731377\n-0.000000 -2.021076 5.731377\nSc H O\n2 2 2\ndirect\n0.745671 0.745671 0.745674 Sc\n0.254328 0.254328 0.254329 Sc\n0.134076 0.134076 0.134077 H\n0.865923 0.865923 0.865927 H\n0.616725 0.616725 0.616728 O\n0.383274 0.383274 0.383276 O\n","nsites":6,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":3.38327408704491,"density_atomic":0.0986450136068679,"volume":60.824159079261,"volume_molar":6.104860793065696,"formula_full":"Sc2 H2 O2","formula_reduced":"ScHO","formula_anonymous":"ABC","energy_above_hull":1.4645429166666666,"spacegroup":166},{"id":"jvasp-118483","created_at":"2022-09-04T14:38:45.000173Z","updated_at":"2022-09-04T14:38:45.000199Z","structure_string":"Sc1 H1 O1\n1.0\n3.138817 0.980458 0.000000\n1.665436 5.611624 0.000000\n0.000000 0.000000 3.127195\nSc H O\n1 1 1\ndirect\n0.144920 0.307481 0.000000 Sc\n0.093505 -0.143070 0.000000 H\n-0.111860 0.062292 0.000000 O\n","nsites":3,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":2.0588522446127406,"density_atomic":0.06002928005804764,"volume":49.97561185306626,"volume_molar":10.03200563820965,"formula_full":"Sc1 H1 O1","formula_reduced":"ScHO","formula_anonymous":"ABC","energy_above_hull":1.86937625,"spacegroup":25},{"id":"jvasp-118486","created_at":"2022-09-04T14:38:51.629530Z","updated_at":"2022-09-04T14:38:51.629566Z","structure_string":"Sc1 H1 O1\n1.0\n3.185689 -0.000000 -0.000000\n0.000000 3.185689 0.000000\n-0.000000 0.000000 6.094926\nSc H O\n1 1 1\ndirect\n0.000000 0.000000 0.726509 Sc\n0.000000 0.000000 0.183907 H\n0.000000 0.000000 0.025350 O\n","nsites":3,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":1.6634437175241896,"density_atomic":0.04850048323834027,"volume":61.85505379930855,"volume_molar":12.416661356560295,"formula_full":"Sc1 H1 O1","formula_reduced":"ScHO","formula_anonymous":"ABC","energy_above_hull":1.96538625,"spacegroup":99},{"id":"jvasp-118488","created_at":"2022-09-04T14:38:34.140645Z","updated_at":"2022-09-04T14:38:34.140669Z","structure_string":"Sc2 H2 O2\n1.0\n3.599232 0.000000 0.000000\n0.000000 3.599232 0.000000\n0.000000 0.000000 4.943024\nSc H O\n2 2 2\ndirect\n0.000000 0.499999 0.713212 Sc\n0.499999 0.000000 0.286787 Sc\n0.000000 0.000000 0.000000 H\n0.499999 0.499999 0.000000 H\n0.499999 0.499999 0.499999 O\n0.000000 0.000000 0.499999 O\n","nsites":6,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":3.2136671530731373,"density_atomic":0.0936998398257871,"volume":64.0342610100038,"volume_molar":6.427055554413712,"formula_full":"Sc2 H2 O2","formula_reduced":"ScHO","formula_anonymous":"ABC","energy_above_hull":1.4870762499999997,"spacegroup":129},{"id":"jvasp-118489","created_at":"2022-09-04T14:38:52.981303Z","updated_at":"2022-09-04T14:38:52.981318Z","structure_string":"Sc1 H2 O2\n1.0\n3.768717 0.000000 -0.000000\n-1.884359 3.263805 -0.000000\n0.000000 0.000000 3.784114\nSc H O\n1 2 2\ndirect\n0.000000 0.000000 0.938442 Sc\n0.666668 0.333333 0.079448 H\n0.333334 0.666666 0.424276 H\n0.666668 0.333333 0.813455 O\n0.333334 0.666666 0.166852 O\n","nsites":5,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":2.8172964602856005,"density_atomic":0.10742072094605028,"volume":46.5459545976343,"volume_molar":5.606125807910458,"formula_full":"Sc1 H2 O2","formula_reduced":"Sc(HO)2","formula_anonymous":"AB2C2","energy_above_hull":2.36719245,"spacegroup":156},{"id":"jvasp-29788","created_at":"2022-09-04T14:37:07.255327Z","updated_at":"2022-09-04T14:37:07.255354Z","structure_string":"Sc2 H2 O4\n1.0\n1.630331 6.463587 0.000000\n-1.630331 6.463587 0.000000\n0.000000 0.000000 4.048765\nSc H O\n2 2 4\ndirect\n0.675580 0.675580 0.249101 Sc\n0.324420 0.324420 0.749101 Sc\n0.015210 0.015210 0.435361 H\n0.984791 0.984791 0.935360 H\n0.285439 0.285439 0.250078 O\n0.714562 0.714562 0.750077 O\n0.068882 0.068882 0.254858 O\n0.931118 0.931118 0.754858 O\n","nsites":8,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":3.0343365325416753,"density_atomic":0.09375361791690266,"volume":85.33004035205019,"volume_molar":6.423368925706578,"formula_full":"Sc2 H2 O4","formula_reduced":"ScHO2","formula_anonymous":"ABC2","energy_above_hull":1.8045630625,"spacegroup":36},{"id":"jvasp-118487","created_at":"2022-09-04T14:38:50.755589Z","updated_at":"2022-09-04T14:38:50.755610Z","structure_string":"Sc1 H1 O2\n1.0\n1.552060 0.896082 4.293367\n-1.552060 0.896082 4.293367\n-0.000000 -1.792165 4.293367\nSc H O\n1 1 2\ndirect\n0.500001 0.500001 0.500001 Sc\n0.000000 0.000000 0.000000 H\n0.250876 0.250876 0.250876 O\n0.749126 0.749126 0.749126 O\n","nsites":4,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":3.6135162790440774,"density_atomic":0.11164886324531414,"volume":35.826607488257416,"volume_molar":5.393821831188905,"formula_full":"Sc1 H1 O2","formula_reduced":"ScHO2","formula_anonymous":"ABC2","energy_above_hull":2.0464305625000003,"spacegroup":166},{"id":"jvasp-108839","created_at":"2022-09-04T14:38:18.791906Z","updated_at":"2022-09-04T14:38:18.791930Z","structure_string":"Sc1 H1 O2\n1.0\n3.040286 0.000696 3.820635\n1.335133 2.731439 3.820635\n0.001115 0.000696 4.882682\nSc H O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.499999 0.500002 0.500000 H\n0.410233 0.410235 0.410234 O\n0.589765 0.589768 0.589767 O\n","nsites":4,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":3.194428211136872,"density_atomic":0.09870006136696961,"volume":40.52682383983417,"volume_molar":6.1014559429801265,"formula_full":"Sc1 H1 O2","formula_reduced":"ScHO2","formula_anonymous":"ABC2","energy_above_hull":1.8169530625,"spacegroup":166},{"id":"jvasp-118485","created_at":"2022-09-04T14:38:34.069026Z","updated_at":"2022-09-04T14:38:34.069051Z","structure_string":"Sc1 H1 O2\n1.0\n3.251849 0.000000 0.000000\n0.000000 3.251849 0.000000\n0.000000 0.000000 3.898512\nSc H O\n1 1 2\ndirect\n0.500000 0.500000 0.530049 Sc\n0.000000 0.000000 0.846350 H\n0.000000 0.000000 0.591144 O\n0.500000 0.500000 0.042455 O\n","nsites":4,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":3.140335756160852,"density_atomic":0.09702873608659242,"volume":41.22490059470873,"volume_molar":6.2065538549585915,"formula_full":"Sc1 H1 O2","formula_reduced":"ScHO2","formula_anonymous":"ABC2","energy_above_hull":1.8889630625,"spacegroup":99},{"id":"jvasp-12150","created_at":"2022-09-04T14:36:06.640286Z","updated_at":"2022-09-04T14:36:06.640307Z","structure_string":"Sc2 H2 O4\n1.0\n1.832088 5.507571 1.070665\n-1.993829 5.472690 0.656907\n0.581464 0.460183 3.776851\nSc H O\n2 2 4\ndirect\n0.444217 0.800671 0.330912 Sc\n0.580365 0.164514 0.694770 Sc\n0.060669 0.467559 0.448960 H\n-0.018237 0.046434 0.027854 H\n0.348481 0.248617 0.279741 O\n0.643830 0.755725 0.733377 O\n-0.118576 0.215644 0.246805 O\n0.137500 0.762072 0.739675 O\n","nsites":8,"nelements":3,"elements":["Sc","H","O"],"chemical_system":"H-O-Sc","density":3.3844402265054816,"density_atomic":0.10457097044295378,"volume":76.50306740114084,"volume_molar":5.758903005767969,"formula_full":"Sc2 H2 O4","formula_reduced":"ScHO2","formula_anonymous":"ABC2","energy_above_hull":1.8306280625,"spacegroup":9}]}