{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3503","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3501","results":[{"id":"jvasp-112436","created_at":"2022-09-04T14:38:40.100242Z","updated_at":"2022-09-04T14:38:40.100272Z","structure_string":"Li1 V3 Zn2 O8\n1.0\n5.120146 0.036436 3.005525\n1.738181 4.816218 3.005525\n0.051496 0.036436 5.936869\nLi V Zn O\n1 3 2 8\ndirect\n0.500000 0.500001 0.500000 Li\n0.500000 0.500001 0.000000 V\n0.500000 0.000001 0.500000 V\n0.000000 0.500001 0.500000 V\n0.121987 0.121988 0.121987 Zn\n0.878013 0.878015 0.878013 Zn\n0.742518 0.742519 0.742518 O\n0.285711 0.747601 0.747600 O\n0.714290 0.252401 0.252400 O\n0.252400 0.252401 0.714289 O\n0.252400 0.714290 0.252400 O\n0.257483 0.257483 0.257483 O\n0.747601 0.285712 0.747600 O\n0.747601 0.747601 0.285711 O\n","nsites":14,"nelements":4,"elements":["Li","V","Zn","O"],"chemical_system":"Li-O-V-Zn","density":4.796355348400023,"density_atomic":0.09660801630430745,"volume":144.9155104882925,"volume_molar":6.23358287476967,"formula_full":"Li1 V3 Zn2 O8","formula_reduced":"LiV3Zn2O8","formula_anonymous":"AB2C3D8","energy_above_hull":2.477034385714286,"spacegroup":166},{"id":"jvasp-116706","created_at":"2022-09-04T14:38:43.998609Z","updated_at":"2022-09-04T14:38:43.998625Z","structure_string":"Cr4 In1 Ag1 Se8\n1.0\n6.619830 0.000000 3.821961\n2.206610 6.241236 3.821961\n-0.000000 -0.000000 7.643921\nCr In Ag Se\n4 1 1 8\ndirect\n0.379082 0.379082 0.379082 Cr\n0.379082 0.862754 0.379081 Cr\n0.862753 0.379082 0.379082 Cr\n0.379082 0.379082 0.862753 Cr\n0.000000 0.000000 0.000000 In\n0.750000 0.750001 0.750000 Ag\n0.140307 0.140307 0.140307 Se\n0.140307 0.579077 0.140307 Se\n0.579077 0.140307 0.140307 Se\n0.140307 0.140307 0.579077 Se\n0.610986 0.610986 0.610985 Se\n0.610986 0.167044 0.610985 Se\n0.167044 0.610986 0.610985 Se\n0.610986 0.610986 0.167044 Se\n","nsites":14,"nelements":4,"elements":["Cr","In","Ag","Se"],"chemical_system":"Ag-Cr-In-Se","density":5.585773655508156,"density_atomic":0.04432966038333518,"volume":315.81563853493924,"volume_molar":13.584901639047743,"formula_full":"Cr4 In1 Ag1 Se8","formula_reduced":"Cr4InAgSe8","formula_anonymous":"ABC4D8","energy_above_hull":2.570563125952382,"spacegroup":216},{"id":"jvasp-119326","created_at":"2022-09-04T14:38:49.472550Z","updated_at":"2022-09-04T14:38:49.472578Z","structure_string":"Li2 Mn2 F10\n1.0\n5.143933 0.079455 -0.461054\n2.487096 4.622735 1.540519\n-0.010758 -0.088188 7.001369\nLi Mn F\n2 2 10\ndirect\n0.314833 0.297441 0.767203 Li\n0.685168 0.702557 0.232798 Li\n-0.000000 -0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.137674 0.010718 0.256316 F\n0.216663 0.163234 0.562404 F\n0.025789 0.653664 0.126328 F\n0.313162 0.643730 0.629652 F\n0.616304 0.174202 0.013004 F\n0.862327 0.989280 0.743685 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S\n0.828844 0.511041 0.657688 S\n0.086477 0.828512 0.172952 S\n0.913543 0.171485 0.827086 S\n0.423820 0.849409 0.847639 S\n0.576184 0.150570 0.152367 S\n","nsites":14,"nelements":3,"elements":["Rb","Cr","S"],"chemical_system":"Cr-Rb-S","density":3.8000291629287855,"density_atomic":0.05322212934940034,"volume":263.0484757212695,"volume_molar":11.315106767835195,"formula_full":"Rb1 Cr5 S8","formula_reduced":"RbCr5S8","formula_anonymous":"AB5C8","energy_above_hull":3.305120500000001,"spacegroup":12},{"id":"jvasp-116664","created_at":"2022-09-04T14:38:44.139112Z","updated_at":"2022-09-04T14:38:44.139136Z","structure_string":"Nd2 Sm6 Sb6\n1.0\n7.684125 0.001280 2.716506\n-3.849796 6.650177 2.716506\n0.000085 0.000148 8.139279\nNd Sm Sb\n2 6 6\ndirect\n0.500780 0.642226 0.999577 Nd\n0.642226 0.500780 0.499577 Nd\n0.143738 0.500173 0.498969 Sm\n0.999260 0.998663 0.858160 Sm\n0.358595 0.857271 0.643329 Sm\n0.500174 0.143738 0.998969 Sm\n0.998663 0.999260 0.358160 Sm\n0.857270 0.358595 0.143329 Sm\n0.625143 0.878863 0.248893 Sb\n0.878864 0.625143 0.748892 Sb\n0.372176 0.245394 0.376823 Sb\n0.126027 0.751698 0.124254 Sb\n0.751698 0.126027 0.624254 Sb\n0.245394 0.372176 0.876823 Sb\n","nsites":14,"nelements":3,"elements":["Nd","Sm","Sb"],"chemical_system":"Nd-Sb-Sm","density":7.66961537766329,"density_atomic":0.033657281971843915,"volume":415.9575336984054,"volume_molar":17.892534415101718,"formula_full":"Nd2 Sm6 Sb6","formula_reduced":"Nd(SmSb)3","formula_anonymous":"AB3C3","energy_above_hull":1.6480366321428574,"spacegroup":9},{"id":"jvasp-112876","created_at":"2022-09-04T14:38:44.175152Z","updated_at":"2022-09-04T14:38:44.175169Z","structure_string":"Sr2 Ga4 Se8\n1.0\n6.316442 0.032003 0.000000\n-3.164240 5.466813 0.000000\n0.000000 0.000000 10.996780\nSr Ga Se\n2 4 8\ndirect\n0.500000 0.499999 0.750000 Sr\n0.500000 0.499999 0.250000 Sr\n0.763404 0.239568 0.500000 Ga\n0.236595 0.760431 0.500000 Ga\n0.760431 0.236595 -0.000000 Ga\n0.239568 0.763404 -0.000000 Ga\n0.346366 0.187712 0.500000 Se\n0.653633 0.812287 0.500000 Se\n0.812287 0.653633 -0.000000 Se\n0.187712 0.346366 -0.000000 Se\n0.500000 -0.000000 0.828936 Se\n-0.000000 0.500000 0.671064 Se\n0.500000 -0.000000 0.171064 Se\n-0.000000 0.500000 0.328936 Se\n","nsites":14,"nelements":3,"elements":["Sr","Ga","Se"],"chemical_system":"Ga-Se-Sr","density":4.734342976212804,"density_atomic":0.036760720775063295,"volume":380.84128125955914,"volume_molar":16.38199859259868,"formula_full":"Sr2 Ga4 Se8","formula_reduced":"Sr(GaSe2)2","formula_anonymous":"AB2C4","energy_above_hull":0.5142877752380952,"spacegroup":66},{"id":"jvasp-112875","created_at":"2022-09-04T14:38:44.157146Z","updated_at":"2022-09-04T14:38:44.157172Z","structure_string":"Mg4 Si2 O8\n1.0\n5.632635 -0.012192 -1.811042\n-2.995692 4.769963 -1.811042\n0.006757 0.012192 5.916621\nMg Si O\n4 2 8\ndirect\n0.125000 0.701741 0.076742 Mg\n0.625000 0.048258 0.923258 Mg\n0.298258 0.375000 0.423258 Mg\n0.951742 0.875000 0.576742 Mg\n0.750000 0.250000 0.500000 Si\n0.500000 0.500000 0.000000 Si\n0.439160 0.643345 0.807429 O\n0.810840 0.118269 0.704186 O\n0.835917 0.631731 0.192571 O\n0.414083 0.106654 0.295814 O\n0.356654 0.164083 0.795814 O\n0.893345 0.189160 0.307429 O\n0.368269 0.560840 0.204186 O\n0.881731 0.585917 0.692571 O\n","nsites":14,"nelements":3,"elements":["Mg","Si","O"],"chemical_system":"Mg-O-Si","density":2.938742528875797,"density_atomic":0.08805168711673145,"volume":158.99752132449194,"volume_molar":6.839324670765658,"formula_full":"Mg4 Si2 O8","formula_reduced":"Mg2SiO4","formula_anonymous":"AB2C4","energy_above_hull":1.3739286714285712,"spacegroup":122},{"id":"jvasp-112678","created_at":"2022-09-04T14:38:41.707106Z","updated_at":"2022-09-04T14:38:41.707133Z","structure_string":"In5 Cu1 Te8\n1.0\n7.666641 -0.023791 -0.001626\n-2.555036 7.228398 -0.001626\n-0.009077 -0.012793 8.830190\nIn Cu Te\n5 1 8\ndirect\n0.510413 0.489587 -0.000000 In\n0.990682 0.009318 0.500000 In\n0.501058 0.498942 0.500000 In\n0.511089 0.010792 0.242117 In\n0.989208 0.488912 0.757882 In\n0.998038 0.001962 -0.000000 Cu\n0.898928 0.642115 0.026242 Te\n0.387949 0.106925 0.531280 Te\n0.357885 0.101073 0.973757 Te\n0.893075 0.612052 0.468719 Te\n0.839457 0.098849 0.768388 Te\n0.332321 0.611257 0.247430 Te\n0.901151 0.160542 0.231611 Te\n0.388743 0.667680 0.752570 Te\n","nsites":14,"nelements":3,"elements":["In","Cu","Te"],"chemical_system":"Cu-In-Te","density":5.633878791776563,"density_atomic":0.028640969907077984,"volume":488.81026185290636,"volume_molar":21.026315727219004,"formula_full":"In5 Cu1 Te8","formula_reduced":"In5CuTe8","formula_anonymous":"AB5C8","energy_above_hull":0.3688344595238094,"spacegroup":5},{"id":"jvasp-21614","created_at":"2022-09-04T14:38:39.749001Z","updated_at":"2022-09-04T14:38:39.749032Z","structure_string":"Lu6 B2 C6\n1.0\n3.522298 0.001293 0.000000\n-0.020925 3.522236 0.000000\n-0.000000 -0.000000 15.680957\nLu B C\n6 2 6\ndirect\n0.576143 0.423857 0.895710 Lu\n0.423857 0.576143 0.395710 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Li\n0.876889 0.876909 0.876896 Li\n0.499998 0.000003 0.499998 Mn\n0.499999 0.499999 0.000001 Mn\n0.000002 0.499998 0.499999 Mn\n0.500000 0.500000 0.500000 Ga\n0.262958 0.262927 0.262931 O\n0.713576 0.257362 0.257366 O\n0.257367 0.713584 0.257388 O\n0.257363 0.257376 0.713580 O\n0.742635 0.286417 0.742610 O\n0.742639 0.742625 0.286417 O\n0.286426 0.742638 0.742632 O\n0.737045 0.737074 0.737067 O\n","nsites":14,"nelements":4,"elements":["Li","Mn","Ga","O"],"chemical_system":"Ga-Li-Mn-O","density":4.565526425338502,"density_atomic":0.10225949524729264,"volume":136.90660183823522,"volume_molar":5.8890773374509084,"formula_full":"Li2 Mn3 Ga1 O8","formula_reduced":"Li2Mn3GaO8","formula_anonymous":"AB2C3D8","energy_above_hull":2.7616430035098523,"spacegroup":166},{"id":"jvasp-112799","created_at":"2022-09-04T14:38:44.356655Z","updated_at":"2022-09-04T14:38:44.356683Z","structure_string":"Li2 Co2 P2 O8\n1.0\n4.519033 -0.496826 2.554404\n-1.900833 7.856735 -3.451476\n-0.009732 -0.560040 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0.000000\n-2.960254 5.127311 0.000000\n-0.000000 -0.000000 7.843417\nK Ba Bi O\n1 2 2 9\ndirect\n0.000000 0.000000 0.000000 K\n0.666667 0.333333 0.354636 Ba\n0.333334 0.666667 0.645364 Ba\n0.333334 0.666667 0.159108 Bi\n0.666667 0.333333 0.840893 Bi\n0.500000 -0.000000 -0.000000 O\n0.824849 0.649697 0.667326 O\n0.175152 0.350303 0.332674 O\n0.824849 0.175151 0.667326 O\n0.175152 0.824849 0.332674 O\n0.500000 0.500000 -0.000000 O\n0.649698 0.824849 0.332674 O\n0.000000 0.500000 -0.000000 O\n0.350303 0.175151 0.667326 O\n","nsites":14,"nelements":4,"elements":["K","Ba","Bi","O"],"chemical_system":"Ba-Bi-K-O","density":6.10737032375626,"density_atomic":0.0587995529628711,"volume":238.0970482690622,"volume_molar":10.241813851548622,"formula_full":"K1 Ba2 Bi2 O9","formula_reduced":"KBa2Bi2O9","formula_anonymous":"AB2C2D9","energy_above_hull":1.851455717142857,"spacegroup":164}]}