{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-spacegroup&page=3457","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-spacegroup&page=3455","results":[{"id":"jvasp-48632","created_at":"2022-09-04T14:37:00.976979Z","updated_at":"2022-09-04T14:37:00.977001Z","structure_string":"Co8 O12 F4\n1.0\n4.368350 -0.111038 0.000000\n-0.111038 4.368350 -0.000000\n-0.000000 0.000000 11.602261\nCo O F\n8 12 4\ndirect\n0.000000 0.000000 0.000000 Co\n0.989535 0.010464 0.250000 Co\n0.000000 0.000000 0.500000 Co\n0.010464 0.989535 0.750000 Co\n0.526266 0.473734 0.125211 Co\n0.473734 0.526266 0.625211 Co\n0.526266 0.473734 0.374789 Co\n0.473734 0.526266 0.874789 Co\n0.813575 0.186425 0.374728 O\n0.813575 0.186425 0.125271 O\n0.681327 0.711558 0.750000 O\n0.695746 0.695746 0.500000 O\n0.711558 0.681327 0.250000 O\n0.695746 0.695746 0.000000 O\n0.318672 0.288442 0.250000 O\n0.288442 0.318672 0.750000 O\n0.304253 0.304253 0.000000 O\n0.186425 0.813575 0.874728 O\n0.186425 0.813575 0.625271 O\n0.304253 0.304253 0.500000 O\n0.787152 0.212847 0.628721 F\n0.212847 0.787152 0.128721 F\n0.212847 0.787152 0.371279 F\n0.787152 0.212847 0.871279 F\n","nsites":24,"nelements":3,"elements":["Co","O","F"],"chemical_system":"Co-F-O","density":5.549607613734295,"density_atomic":0.10847120122544371,"volume":221.25688412096616,"volume_molar":5.551833751231113,"formula_full":"Co8 O12 F4","formula_reduced":"Co2O3F","formula_anonymous":"AB2C3","energy_above_hull":2.309327097083333,"spacegroup":63},{"id":"jvasp-3063","created_at":"2022-09-04T14:37:01.501166Z","updated_at":"2022-09-04T14:37:01.501202Z","structure_string":"K2 Au2 Se2\n1.0\n5.164433 -0.010163 0.000000\n-1.137035 5.037720 0.000000\n0.000000 0.000000 6.848573\nK Au Se\n2 2 2\ndirect\n0.364211 0.635788 0.750000 K\n0.635787 0.364212 0.250000 K\n0.000000 0.000000 0.000000 Au\n0.000000 0.000000 0.500000 Au\n0.781478 0.218522 0.750000 Se\n0.218521 0.781479 0.250000 Se\n","nsites":6,"nelements":3,"elements":["K","Au","Se"],"chemical_system":"Au-K-Se","density":5.874353932027489,"density_atomic":0.033688946251053856,"volume":178.09996060094366,"volume_molar":17.87571720148895,"formula_full":"K2 Au2 Se2","formula_reduced":"KAuSe","formula_anonymous":"ABC","energy_above_hull":0.0683765007407408,"spacegroup":63},{"id":"jvasp-104885","created_at":"2022-09-04T14:37:02.086466Z","updated_at":"2022-09-04T14:37:02.086491Z","structure_string":"Ce2 Si2 Ru4 C2\n1.0\n5.940731 0.004331 0.000000\n-4.658418 3.686657 0.000000\n0.000000 0.000000 7.125825\nCe Si Ru C\n2 2 4 2\ndirect\n0.553070 0.446930 0.250000 Ce\n0.446930 0.553070 0.750001 Ce\n0.273313 0.726688 0.250000 Si\n0.726687 0.273313 0.750001 Si\n0.835727 0.164272 0.056408 Ru\n0.164272 0.835728 0.943592 Ru\n0.164272 0.835728 0.556409 Ru\n0.835727 0.164272 0.443592 Ru\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n","nsites":10,"nelements":4,"elements":["Ce","Si","Ru","C"],"chemical_system":"C-Ce-Ru-Si","density":8.128960716881236,"density_atomic":0.06401656076058498,"volume":156.20957891503917,"volume_molar":9.407160722866939,"formula_full":"Ce2 Si2 Ru4 C2","formula_reduced":"CeSiRu2C","formula_anonymous":"ABCD2","energy_above_hull":4.21640502,"spacegroup":63},{"id":"jvasp-28448","created_at":"2022-09-04T14:37:01.643189Z","updated_at":"2022-09-04T14:37:01.643213Z","structure_string":"Ba2 In4 Pd2\n1.0\n4.580434 0.000000 -0.000000\n-2.290218 5.897327 0.000000\n-0.000000 0.000000 8.145620\nBa In Pd\n2 4 2\ndirect\n0.447958 0.895919 0.250000 Ba\n0.552041 0.104082 0.750000 Ba\n0.161976 0.323953 0.055663 In\n0.838022 0.676047 0.944337 In\n0.838022 0.676047 0.555663 In\n0.161976 0.323953 0.444337 In\n0.723790 0.447583 0.250000 Pd\n0.276208 0.552418 0.750000 Pd\n","nsites":8,"nelements":3,"elements":["Ba","In","Pd"],"chemical_system":"Ba-In-Pd","density":7.145058113393719,"density_atomic":0.036358336241146615,"volume":220.03207041543405,"volume_molar":16.563301246949692,"formula_full":"Ba2 In4 Pd2","formula_reduced":"BaIn2Pd","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":63},{"id":"jvasp-36130","created_at":"2022-09-04T14:37:02.042951Z","updated_at":"2022-09-04T14:37:02.042972Z","structure_string":"Hf2 Pt2\n1.0\n-3.409696 0.000000 -0.000000\n-0.000000 0.000000 -4.276285\n-1.704849 -5.164055 0.000000\nHf Pt\n2 2\ndirect\n0.142302 0.750001 0.715397 Hf\n0.857699 0.250000 0.284604 Hf\n0.406115 0.750001 0.187771 Pt\n0.593886 0.250000 0.812230 Pt\n","nsites":4,"nelements":2,"elements":["Hf","Pt"],"chemical_system":"Hf-Pt","density":16.47716818938933,"density_atomic":0.053123518337458125,"volume":75.2962176674873,"volume_molar":11.336110537230184,"formula_full":"Hf2 Pt2","formula_reduced":"HfPt","formula_anonymous":"AB","energy_above_hull":2.1072872000000005,"spacegroup":63},{"id":"jvasp-12093","created_at":"2022-09-04T14:37:02.058950Z","updated_at":"2022-09-04T14:37:02.058974Z","structure_string":"Ta4 Ni2 S10\n1.0\n3.424870 0.000000 0.000000\n-1.712435 6.138978 -0.000000\n0.000000 -0.000000 15.199651\nTa Ni S\n4 2 10\ndirect\n0.221141 0.442283 0.608536 Ta\n0.778860 0.557718 0.391464 Ta\n0.778860 0.557718 0.108536 Ta\n0.221141 0.442283 0.891463 Ta\n0.301759 0.603516 0.250000 Ni\n0.698243 0.396484 0.750000 Ni\n0.680497 0.360993 0.250000 S\n0.319505 0.639007 0.750000 S\n0.148741 0.297480 0.450326 S\n0.851261 0.702521 0.549674 S\n0.851261 0.702521 0.950326 S\n0.148741 0.297480 0.049674 S\n0.583794 0.167587 0.864148 S\n0.416207 0.832413 0.135852 S\n0.416207 0.832413 0.364148 S\n0.583794 0.167587 0.635852 S\n","nsites":16,"nelements":3,"elements":["Ta","Ni","S"],"chemical_system":"Ni-S-Ta","density":6.036945723617852,"density_atomic":0.050066380782551954,"volume":319.57572626411957,"volume_molar":12.02831254401098,"formula_full":"Ta4 Ni2 S10","formula_reduced":"Ta2NiS5","formula_anonymous":"AB2C5","energy_above_hull":3.360107599999999,"spacegroup":63},{"id":"jvasp-19068","created_at":"2022-09-04T14:37:02.181249Z","updated_at":"2022-09-04T14:37:02.181273Z","structure_string":"Nd6 Nb2 O14\n1.0\n6.671258 -0.017131 0.000000\n-2.427046 6.214130 0.000000\n-0.000000 0.000000 7.726647\nNd Nb O\n6 2 14\ndirect\n0.926165 0.475680 0.750000 Nd\n0.000000 0.000000 0.000000 Nd\n0.000000 0.000000 0.500000 Nd\n0.524320 0.073835 0.250000 Nd\n0.475679 0.926165 0.750000 Nd\n0.073835 0.524320 0.250000 Nd\n0.500000 0.500000 0.500000 Nb\n0.500000 0.500000 0.000000 Nb\n0.438395 0.183926 0.537424 O\n0.561605 0.816074 0.037424 O\n0.816074 0.561606 0.037424 O\n0.576162 0.576162 0.750000 O\n0.438395 0.183926 0.962577 O\n0.816074 0.561606 0.462577 O\n0.183925 0.438394 0.962577 O\n0.155578 0.893844 0.250000 O\n0.844422 0.106156 0.750000 O\n0.893844 0.155578 0.250000 O\n0.106156 0.844422 0.750000 O\n0.423838 0.423838 0.250000 O\n0.561605 0.816074 0.462577 O\n0.183925 0.438394 0.537424 O\n","nsites":22,"nelements":3,"elements":["Nd","Nb","O"],"chemical_system":"Nb-Nd-O","density":6.617641565861004,"density_atomic":0.06875104849486936,"volume":319.9951198073987,"volume_molar":8.759343881787359,"formula_full":"Nd6 Nb2 O14","formula_reduced":"Nd3NbO7","formula_anonymous":"AB3C7","energy_above_hull":2.689237127272727,"spacegroup":63},{"id":"jvasp-49750","created_at":"2022-09-04T14:37:02.332537Z","updated_at":"2022-09-04T14:37:02.332561Z","structure_string":"Nd6 Sb2 O14\n1.0\n5.490128 3.789926 0.000000\n-5.490128 3.789926 0.000000\n0.000000 -0.000000 7.710030\nNd Sb O\n6 2 14\ndirect\n0.066618 0.520195 0.250000 Nd\n0.479806 0.933383 0.750000 Nd\n0.000000 0.000000 0.000000 Nd\n0.000000 0.000000 0.500000 Nd\n0.520195 0.066618 0.250000 Nd\n0.933383 0.479806 0.750000 Nd\n0.500000 0.500000 0.000000 Sb\n0.500000 0.500000 0.500000 Sb\n0.813734 0.560539 0.464839 O\n0.439462 0.186267 0.535161 O\n0.813734 0.560539 0.035161 O\n0.439462 0.186267 0.964838 O\n0.416231 0.416231 0.250000 O\n0.583770 0.583770 0.750000 O\n0.186267 0.439462 0.535161 O\n0.560539 0.813734 0.464839 O\n0.560539 0.813734 0.035161 O\n0.847173 0.110642 0.750000 O\n0.152828 0.889359 0.250000 O\n0.110642 0.847173 0.750000 O\n0.186267 0.439462 0.964838 O\n0.889359 0.152828 0.250000 O\n","nsites":22,"nelements":3,"elements":["Nd","Sb","O"],"chemical_system":"Nd-O-Sb","density":6.898713729168292,"density_atomic":0.06856830549579651,"volume":320.84794630587277,"volume_molar":8.782688614594944,"formula_full":"Nd6 Sb2 O14","formula_reduced":"Nd3SbO7","formula_anonymous":"AB3C7","energy_above_hull":2.295568645454545,"spacegroup":63},{"id":"jvasp-107711","created_at":"2022-09-04T14:37:02.478093Z","updated_at":"2022-09-04T14:37:02.478112Z","structure_string":"Y2 Si2 Ru4 C2\n1.0\n5.889930 -0.010613 0.000000\n-4.656549 3.606653 0.000000\n-0.000000 -0.000000 7.142093\nY Si Ru C\n2 2 4 2\ndirect\n0.547109 0.452891 0.250000 Y\n0.452890 0.547109 0.750000 Y\n0.269025 0.730974 0.250000 Si\n0.730974 0.269026 0.750000 Si\n0.836181 0.163820 0.056307 Ru\n0.163819 0.836180 0.943693 Ru\n0.163819 0.836180 0.556307 Ru\n0.836181 0.163820 0.443693 Ru\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n","nsites":10,"nelements":4,"elements":["Y","Si","Ru","C"],"chemical_system":"C-Ru-Si-Y","density":7.265490834073714,"density_atomic":0.06606501425657371,"volume":151.36604619751463,"volume_molar":9.115476364860958,"formula_full":"Y2 Si2 Ru4 C2","formula_reduced":"YSiRu2C","formula_anonymous":"ABCD2","energy_above_hull":4.36313301,"spacegroup":63},{"id":"jvasp-2640","created_at":"2022-09-04T14:37:02.532332Z","updated_at":"2022-09-04T14:37:02.532370Z","structure_string":"Na4 Sb2 Au2\n1.0\n5.932414 0.000000 0.000000\n0.000000 5.829331 -1.224334\n0.000000 -0.022729 5.956474\nNa Sb Au\n4 2 2\ndirect\n0.250000 0.651686 0.010383 Na\n0.750000 0.348314 0.989617 Na\n0.250000 0.010383 0.651685 Na\n0.750000 0.989617 0.348315 Na\n0.750000 0.802208 0.802208 Sb\n0.250000 0.197792 0.197792 Sb\n0.500000 0.500000 0.500000 Au\n0.000000 0.500000 0.500000 Au\n","nsites":8,"nelements":3,"elements":["Na","Sb","Au"],"chemical_system":"Au-Na-Sb","density":5.88478923826048,"density_atomic":0.03886858861243992,"volume":205.82172611844192,"volume_molar":15.493592576892821,"formula_full":"Na4 Sb2 Au2","formula_reduced":"Na2SbAu","formula_anonymous":"ABC2","energy_above_hull":0.0333929175,"spacegroup":63},{"id":"jvasp-107712","created_at":"2022-09-04T14:37:02.616267Z","updated_at":"2022-09-04T14:37:02.616300Z","structure_string":"Dy2 Mn4 Si2 C2\n1.0\n5.586098 0.004483 0.000000\n-4.360468 3.491536 0.000000\n-0.000000 -0.000000 6.961212\nDy Mn Si C\n2 4 2 2\ndirect\n0.544021 0.455979 0.250000 Dy\n0.455979 0.544021 0.750000 Dy\n0.831597 0.168402 0.061849 Mn\n0.168403 0.831598 0.938151 Mn\n0.168403 0.831598 0.561849 Mn\n0.831597 0.168402 0.438151 Mn\n0.265068 0.734933 0.250000 Si\n0.734933 0.265067 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n","nsites":10,"nelements":4,"elements":["Dy","Mn","Si","C"],"chemical_system":"C-Dy-Mn-Si","density":7.635642983001164,"density_atomic":0.0735791913782659,"volume":135.9079899178375,"volume_molar":8.184570456938784,"formula_full":"Dy2 Mn4 Si2 C2","formula_reduced":"DyMn2SiC","formula_anonymous":"ABCD2","energy_above_hull":3.950965916551724,"spacegroup":63},{"id":"jvasp-13288","created_at":"2022-09-04T14:37:02.650540Z","updated_at":"2022-09-04T14:37:02.650570Z","structure_string":"Na4 S2 O6\n1.0\n5.543878 0.377147 0.000000\n-2.445320 4.989713 -0.000000\n0.000000 0.000000 6.154293\nNa S O\n4 2 6\ndirect\n0.312569 0.687431 0.750000 Na\n0.000055 0.000055 0.000000 Na\n-0.000055 -0.000055 0.500000 Na\n0.687432 0.312569 0.250000 Na\n0.364855 0.635145 0.250000 S\n0.635146 0.364855 0.750000 S\n0.199272 0.800727 0.250000 O\n0.122643 0.353095 0.250074 O\n0.646906 0.877357 0.249926 O\n0.353095 0.122643 0.749926 O\n0.877357 0.646905 0.750074 O\n0.800728 0.199273 0.750000 O\n","nsites":12,"nelements":3,"elements":["Na","S","O"],"chemical_system":"Na-O-S","density":2.3795046415373866,"density_atomic":0.06821358560949785,"volume":175.91803586893045,"volume_molar":8.828359785211902,"formula_full":"Na4 S2 O6","formula_reduced":"Na2SO3","formula_anonymous":"AB2C3","energy_above_hull":1.2179030833333335,"spacegroup":63}]}