{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=3475","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=3473","results":[{"id":"jvasp-18721","created_at":"2022-09-04T14:36:56.235309Z","updated_at":"2022-09-04T14:36:56.235333Z","structure_string":"Mg1 Cd1 Ag2\n1.0\n4.088641 -0.000000 2.360578\n1.362880 3.854808 2.360578\n0.000000 -0.000000 4.721156\nMg Cd Ag\n1 1 2\ndirect\n0.500000 0.500000 0.500001 Mg\n0.000000 0.000000 0.000000 Cd\n0.750000 0.750000 0.750001 Ag\n0.250000 0.250000 0.250000 Ag\n","nsites":4,"nelements":3,"elements":["Mg","Cd","Ag"],"chemical_system":"Ag-Cd-Mg","density":7.865375983809701,"density_atomic":0.05375636689799169,"volume":74.40979052007769,"volume_molar":11.202655810850537,"formula_full":"Mg1 Cd1 Ag2","formula_reduced":"MgCdAg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-2715","created_at":"2022-09-04T14:36:56.237397Z","updated_at":"2022-09-04T14:36:56.237420Z","structure_string":"K1 Ru1 F6\n1.0\n4.935256 -0.028924 -0.674817\n-0.769481 4.874986 -0.674817\n-0.024863 -0.028924 4.981116\nK Ru F\n1 1 6\ndirect\n0.500001 0.500001 0.500000 K\n0.000000 0.000000 0.000000 Ru\n0.269693 0.269693 0.919572 F\n0.269693 0.919573 0.269692 F\n0.730309 0.080430 0.730308 F\n0.730309 0.730309 0.080428 F\n0.080429 0.730309 0.730308 F\n0.919573 0.269693 0.269692 F\n","nsites":8,"nelements":3,"elements":["K","Ru","F"],"chemical_system":"F-K-Ru","density":3.530605780486232,"density_atomic":0.06692449522071837,"volume":119.53769652824178,"volume_molar":8.998410432740442,"formula_full":"K1 Ru1 F6","formula_reduced":"KRuF6","formula_anonymous":"ABC6","energy_above_hull":0.17360476625,"spacegroup":166},{"id":"jvasp-51256","created_at":"2022-09-04T14:37:04.429313Z","updated_at":"2022-09-04T14:37:04.429342Z","structure_string":"Ca1 Hf1 Zn1\n1.0\n0.000026 3.358944 3.358952\n3.358926 0.000020 3.358958\n3.358926 3.358949 0.000020\nCa Hf Zn\n1 1 1\ndirect\n0.499998 0.500001 0.500000 Ca\n0.250000 0.249999 0.250001 Hf\n-0.000000 0.000001 -0.000000 Zn\n","nsites":3,"nelements":3,"elements":["Ca","Hf","Zn"],"chemical_system":"Ca-Hf-Zn","density":6.221553315090016,"density_atomic":0.03958109616863111,"volume":75.79375738405056,"volume_molar":15.214689189868064,"formula_full":"Ca1 Hf1 Zn1","formula_reduced":"CaHfZn","formula_anonymous":"ABC","energy_above_hull":1.3014112733333336,"spacegroup":216},{"id":"jvasp-107641","created_at":"2022-09-04T14:36:56.322870Z","updated_at":"2022-09-04T14:36:56.322879Z","structure_string":"Ge2 N2 O1\n1.0\n4.346299 -0.001034 -3.290490\n-0.441090 2.934460 -4.572966\n0.004843 0.001034 5.451386\nGe N O\n2 2 1\ndirect\n0.576664 0.325808 0.250856 Ge\n0.925049 0.674194 0.250856 Ge\n0.753184 0.800625 0.952559 N\n0.151933 0.199374 0.952558 N\n0.593677 0.500001 0.093677 O\n","nsites":5,"nelements":3,"elements":["Ge","N","O"],"chemical_system":"Ge-N-O","density":4.516626757683685,"density_atomic":0.07184573873003416,"volume":69.59354985252335,"volume_molar":8.382043063999458,"formula_full":"Ge2 N2 O1","formula_reduced":"Ge2N2O","formula_anonymous":"AB2C2","energy_above_hull":2.9370043799999994,"spacegroup":44},{"id":"jvasp-18764","created_at":"2022-09-04T14:36:56.327840Z","updated_at":"2022-09-04T14:36:56.327862Z","structure_string":"Li1 Al2 Pd1\n1.0\n3.739801 -0.000000 2.159175\n1.246601 3.525918 2.159175\n-0.000000 -0.000000 4.318350\nLi Al Pd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250001 Al\n0.750000 0.750000 0.750002 Al\n0.500000 0.500000 0.500001 Pd\n","nsites":4,"nelements":3,"elements":["Li","Al","Pd"],"chemical_system":"Al-Li-Pd","density":4.879428919504681,"density_atomic":0.07024597603297368,"volume":56.942763498970926,"volume_molar":8.572933426354826,"formula_full":"Li1 Al2 Pd1","formula_reduced":"LiAl2Pd","formula_anonymous":"ABC2","energy_above_hull":1.270760325,"spacegroup":225},{"id":"jvasp-2592","created_at":"2022-09-04T14:36:56.363510Z","updated_at":"2022-09-04T14:36:56.363528Z","structure_string":"Ta1 Tl3 S4\n1.0\n6.307723 0.000000 -2.230117\n-3.153861 5.462648 -2.230117\n-0.000000 -0.000000 6.690351\nTa Tl S\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Ta\n0.500000 0.000000 0.500000 Tl\n0.500000 0.500000 -0.000000 Tl\n0.000000 0.500000 0.500000 Tl\n0.000000 0.000000 0.657378 S\n0.000000 0.657378 -0.000000 S\n0.657378 -0.000000 -0.000000 S\n0.342622 0.342622 0.342622 S\n","nsites":8,"nelements":3,"elements":["Ta","Tl","S"],"chemical_system":"S-Ta-Tl","density":6.643910600083068,"density_atomic":0.03470285887923716,"volume":230.52855754159285,"volume_molar":17.353442783940395,"formula_full":"Ta1 Tl3 S4","formula_reduced":"TaTl3S4","formula_anonymous":"AB3C4","energy_above_hull":1.7057121249999996,"spacegroup":217},{"id":"jvasp-102790","created_at":"2022-09-04T14:36:56.526748Z","updated_at":"2022-09-04T14:36:56.526770Z","structure_string":"Cd2 Te1 Se1\n1.0\n4.524792 0.000000 0.000000\n0.000000 4.524792 0.000000\n-0.000000 -0.000000 6.372446\nCd Te Se\n2 1 1\ndirect\n0.500000 0.000000 0.767187 Cd\n-0.000000 0.500000 0.232814 Cd\n0.000000 0.000000 0.500000 Te\n0.500000 0.500000 -0.000000 Se\n","nsites":4,"nelements":3,"elements":["Cd","Te","Se"],"chemical_system":"Cd-Se-Te","density":5.490447122178412,"density_atomic":0.03065890131393671,"volume":130.46781941209707,"volume_molar":19.642389328747726,"formula_full":"Cd2 Te1 Se1","formula_reduced":"Cd2TeSe","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":115},{"id":"jvasp-13351","created_at":"2022-09-04T14:36:56.598901Z","updated_at":"2022-09-04T14:36:56.598924Z","structure_string":"Sr2 Nd4 S8\n1.0\n7.514707 0.002818 -0.004881\n-2.502245 7.085872 0.004881\n-2.510215 -3.541527 6.134106\nSr Nd S\n2 4 8\ndirect\n0.125000 0.750000 0.875000 Sr\n0.375000 0.250000 0.625000 Sr\n0.250000 0.627474 0.377474 Nd\n0.622526 0.372526 0.250000 Nd\n0.750001 0.872526 0.122526 Nd\n0.877475 0.127474 0.750001 Nd\n0.990722 0.847265 0.491657 S\n0.509279 0.000935 0.856544 S\n0.143457 0.152735 0.144391 S\n0.356544 0.500935 0.009279 S\n0.644392 0.652735 0.643457 S\n0.508344 0.999065 0.355609 S\n0.855610 0.499065 0.008343 S\n0.991658 0.347265 0.490722 S\n","nsites":14,"nelements":3,"elements":["Sr","Nd","S"],"chemical_system":"Nd-S-Sr","density":5.127542986181855,"density_atomic":0.04285625052241286,"volume":326.6734683818948,"volume_molar":14.051954351094142,"formula_full":"Sr2 Nd4 S8","formula_reduced":"Sr(NdS2)2","formula_anonymous":"AB2C4","energy_above_hull":1.351089901428571,"spacegroup":122},{"id":"jvasp-50066","created_at":"2022-09-04T14:36:56.611856Z","updated_at":"2022-09-04T14:36:56.611864Z","structure_string":"Y4 Cu2 O7\n1.0\n8.332462 0.000000 0.048136\n-2.048184 1.832040 5.687697\n-2.048184 -1.832040 5.687697\nY Cu O\n4 2 7\ndirect\n0.162779 0.357542 0.357542 Y\n0.321132 0.662835 0.662835 Y\n0.678869 0.337166 0.337166 Y\n0.837222 0.642459 0.642459 Y\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.000000 Cu\n0.120491 0.749013 0.749013 O\n0.000001 0.500000 0.500000 O\n0.711749 0.986102 0.986102 O\n0.387293 0.280408 0.280408 O\n0.612708 0.719593 0.719593 O\n0.288252 0.013899 0.013899 O\n0.879510 0.250988 0.250988 O\n","nsites":13,"nelements":3,"elements":["Y","Cu","O"],"chemical_system":"Cu-O-Y","density":5.6751578118109265,"density_atomic":0.07470782279983057,"volume":174.01122817929962,"volume_molar":8.060923922432469,"formula_full":"Y4 Cu2 O7","formula_reduced":"Y4Cu2O7","formula_anonymous":"A2B4C7","energy_above_hull":2.383520553846154,"spacegroup":12},{"id":"jvasp-105449","created_at":"2022-09-04T14:36:56.626831Z","updated_at":"2022-09-04T14:36:56.626849Z","structure_string":"Mn2 Cd1 Te3\n1.0\n4.072438 0.000000 0.000000\n-2.036219 3.526834 0.000000\n0.000000 -0.000000 10.506649\nMn Cd Te\n2 1 3\ndirect\n0.333333 0.666666 0.657677 Mn\n0.666667 0.333333 0.342323 Mn\n0.000000 0.000000 0.000000 Cd\n0.000000 0.000000 0.500000 Te\n0.333333 0.666666 0.194073 Te\n0.666667 0.333333 0.805927 Te\n","nsites":6,"nelements":3,"elements":["Mn","Cd","Te"],"chemical_system":"Cd-Mn-Te","density":6.6582984893931405,"density_atomic":0.039760105348548354,"volume":150.9050327558818,"volume_molar":15.146189144138848,"formula_full":"Mn2 Cd1 Te3","formula_reduced":"Mn2CdTe3","formula_anonymous":"AB2C3","energy_above_hull":1.70777125545977,"spacegroup":164},{"id":"jvasp-104826","created_at":"2022-09-04T14:36:56.271546Z","updated_at":"2022-09-04T14:36:56.271569Z","structure_string":"Cu1 Ag2 O2\n1.0\n4.118916 -0.026831 -3.820907\n-0.373821 2.793393 -4.860322\n0.046932 0.026831 5.618060\nCu Ag O\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Cu\n0.647552 0.647550 0.000000 Ag\n0.352450 0.352449 0.000000 Ag\n0.867292 0.367291 0.500000 O\n0.132708 0.632708 0.499999 O\n","nsites":5,"nelements":3,"elements":["Cu","Ag","O"],"chemical_system":"Ag-Cu-O","density":7.87155310825204,"density_atomic":0.07614273016502598,"volume":65.66615078239747,"volume_molar":7.909016063579634,"formula_full":"Cu1 Ag2 O2","formula_reduced":"Cu(AgO)2","formula_anonymous":"AB2C2","energy_above_hull":0.7525163939999995,"spacegroup":71},{"id":"jvasp-106698","created_at":"2022-09-04T14:36:56.275578Z","updated_at":"2022-09-04T14:36:56.275598Z","structure_string":"Y2 Fe2 Ni2\n1.0\n4.252483 -0.043711 2.817013\n-2.829555 4.238528 -0.222682\n0.089866 -0.043711 5.100107\nY Fe Ni\n2 2 2\ndirect\n0.500002 0.744759 0.755242 Y\n0.000001 0.005243 0.994758 Y\n0.750001 0.375001 0.874999 Fe\n0.250001 0.375000 0.375000 Fe\n0.250002 0.875001 0.374999 Ni\n0.750001 0.375001 0.374999 Ni\n","nsites":6,"nelements":3,"elements":["Y","Fe","Ni"],"chemical_system":"Fe-Ni-Y","density":7.463335187307315,"density_atomic":0.06627651809165076,"volume":90.52980109339593,"volume_molar":9.08638675265387,"formula_full":"Y2 Fe2 Ni2","formula_reduced":"YFeNi","formula_anonymous":"ABC","energy_above_hull":2.100917783333333,"spacegroup":74}]}