{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=528","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=526","results":[{"id":"jvasp-105131","created_at":"2022-09-04T14:36:53.205608Z","updated_at":"2022-09-04T14:36:53.205635Z","structure_string":"Ca2 Pr6\n1.0\n7.469786 -0.000000 0.000000\n-3.734893 6.469024 0.000000\n-0.000000 -0.000000 5.984303\nCa Pr\n2 6\ndirect\n0.333334 0.666666 0.750000 Ca\n0.666667 0.333333 0.250000 Ca\n0.164888 0.329777 0.250000 Pr\n0.670223 0.835111 0.250000 Pr\n0.164888 0.835111 0.250000 Pr\n0.835112 0.670222 0.750000 Pr\n0.329778 0.164888 0.750000 Pr\n0.835112 0.164888 0.750000 Pr\n","nsites":8,"nelements":2,"elements":["Ca","Pr"],"chemical_system":"Ca-Pr","density":5.315117107168791,"density_atomic":0.027664924530786623,"volume":289.17483548878954,"volume_molar":21.768144544541677,"formula_full":"Ca2 Pr6","formula_reduced":"CaPr3","formula_anonymous":"AB3","energy_above_hull":1.1710174925,"spacegroup":194},{"id":"jvasp-100760","created_at":"2022-09-04T14:36:40.481483Z","updated_at":"2022-09-04T14:36:40.481499Z","structure_string":"Ti3 Zn1\n1.0\n3.625680 0.019230 -3.447398\n-0.654430 3.566181 -3.447398\n-0.015936 -0.019230 5.002985\nTi Zn\n3 1\ndirect\n0.749999 0.250000 0.499999 Ti\n0.249999 0.750000 0.499999 Ti\n0.500000 0.500000 -0.000000 Ti\n0.000000 0.000000 0.000000 Zn\n","nsites":4,"nelements":2,"elements":["Ti","Zn"],"chemical_system":"Ti-Zn","density":5.399998291666158,"density_atomic":0.06223539510532739,"volume":64.27210742745967,"volume_molar":9.67639194675009,"formula_full":"Ti3 Zn1","formula_reduced":"Ti3Zn","formula_anonymous":"AB3","energy_above_hull":2.536257222222223,"spacegroup":139},{"id":"jvasp-15691","created_at":"2022-09-04T14:36:57.917323Z","updated_at":"2022-09-04T14:36:57.917343Z","structure_string":"Sr1 Si1\n1.0\n3.806780 0.000000 0.000000\n0.000000 3.806780 0.000000\n0.000000 0.000000 3.807171\nSr Si\n1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Si\n","nsites":2,"nelements":2,"elements":["Sr","Si"],"chemical_system":"Si-Sr","density":3.4824521617757003,"density_atomic":0.03625033747821317,"volume":55.17190015684739,"volume_molar":16.612647437060055,"formula_full":"Sr1 Si1","formula_reduced":"SrSi","formula_anonymous":"AB","energy_above_hull":0.7464124549999998,"spacegroup":221},{"id":"jvasp-79595","created_at":"2022-09-04T14:36:52.961660Z","updated_at":"2022-09-04T14:36:52.961674Z","structure_string":"Pt2 Pb2\n1.0\n-2.191899 -3.796036 -0.000000\n-2.191899 3.796036 0.000000\n0.000000 0.000000 -5.566163\nPt Pb\n2 2\ndirect\n0.000000 0.000000 0.500000 Pt\n0.000000 0.000000 0.000000 Pt\n0.666647 0.333354 0.750000 Pb\n0.333354 0.666647 0.250000 Pb\n","nsites":4,"nelements":2,"elements":["Pt","Pb"],"chemical_system":"Pb-Pt","density":14.423646704975585,"density_atomic":0.043184034542706425,"volume":92.62682475960507,"volume_molar":13.945294421354873,"formula_full":"Pt2 Pb2","formula_reduced":"PtPb","formula_anonymous":"AB","energy_above_hull":0.8430061099999999,"spacegroup":194},{"id":"jvasp-7633","created_at":"2022-09-04T14:36:58.781711Z","updated_at":"2022-09-04T14:36:58.781727Z","structure_string":"Si1 O2\n1.0\n2.802661 -0.000000 1.618117\n0.934221 2.642375 1.618117\n0.000000 0.000000 3.236234\nSi O\n1 2\ndirect\n0.000000 0.000000 0.000000 Si\n0.750000 0.749999 0.750001 O\n0.250000 0.250000 0.250000 O\n","nsites":3,"nelements":2,"elements":["Si","O"],"chemical_system":"O-Si","density":4.162988058186353,"density_atomic":0.1251746300311112,"volume":23.96651780999371,"volume_molar":4.810991459294302,"formula_full":"Si1 O2","formula_reduced":"SiO2","formula_anonymous":"AB2","energy_above_hull":1.7872218666666668,"spacegroup":225},{"id":"jvasp-79480","created_at":"2022-09-04T14:36:40.481307Z","updated_at":"2022-09-04T14:36:40.481337Z","structure_string":"Ca3 Zn1\n1.0\n4.997917 -0.000000 -0.000000\n-0.000000 4.997917 0.000000\n-0.000000 -0.000000 4.997917\nCa Zn\n3 1\ndirect\n0.500000 0.500000 0.000000 Ca\n0.500000 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Zn\n","nsites":4,"nelements":2,"elements":["Ca","Zn"],"chemical_system":"Ca-Zn","density":2.4692243826957547,"density_atomic":0.03204002694581902,"volume":124.8438400742971,"volume_molar":18.79567944865865,"formula_full":"Ca3 Zn1","formula_reduced":"Ca3Zn","formula_anonymous":"AB3","energy_above_hull":0.0308175,"spacegroup":221},{"id":"jvasp-4337","created_at":"2022-09-04T14:36:45.019966Z","updated_at":"2022-09-04T14:36:45.019983Z","structure_string":"V2 S2\n1.0\n1.591508 -2.756572 0.000000\n1.591508 2.756572 0.000000\n0.000000 0.000000 6.427055\nV S\n2 2\ndirect\n0.666668 0.333334 0.750001 V\n0.333334 0.666668 0.250000 V\n0.000000 0.000000 0.000000 S\n0.000000 0.000000 0.500000 S\n","nsites":4,"nelements":2,"elements":["V","S"],"chemical_system":"S-V","density":4.888448188869624,"density_atomic":0.07093160921497331,"volume":56.39234812616686,"volume_molar":8.490066455067476,"formula_full":"V2 S2","formula_reduced":"VS","formula_anonymous":"AB","energy_above_hull":1.7655170999999998,"spacegroup":194},{"id":"jvasp-15063","created_at":"2022-09-04T14:36:45.028371Z","updated_at":"2022-09-04T14:36:45.028386Z","structure_string":"U1 Si3\n1.0\n4.059812 0.000000 0.000000\n0.000000 4.059812 0.000000\n-0.000000 0.000000 4.059812\nU Si\n1 3\ndirect\n0.000000 0.000000 0.000000 U\n0.000000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 Si\n0.500000 0.000000 0.500000 Si\n","nsites":4,"nelements":2,"elements":["U","Si"],"chemical_system":"Si-U","density":7.997826414796111,"density_atomic":0.05977811587635045,"volume":66.91411968008327,"volume_molar":10.074156188623691,"formula_full":"U1 Si3","formula_reduced":"USi3","formula_anonymous":"AB3","energy_above_hull":3.76979045,"spacegroup":221},{"id":"jvasp-11981","created_at":"2022-09-04T14:36:52.854369Z","updated_at":"2022-09-04T14:36:52.854405Z","structure_string":"Nb6 Al2\n1.0\n5.216911 0.000000 -0.000000\n0.000000 5.216911 -0.000000\n-0.000000 -0.000000 5.216911\nNb Al\n6 2\ndirect\n0.250000 0.000000 0.500000 Nb\n0.750000 0.000000 0.500000 Nb\n0.000000 0.500000 0.250000 Nb\n0.000000 0.500000 0.750000 Nb\n0.500000 0.750000 0.000000 Nb\n0.500000 0.250000 0.000000 Nb\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n","nsites":8,"nelements":2,"elements":["Nb","Al"],"chemical_system":"Al-Nb","density":7.150480269429586,"density_atomic":0.056344263148114214,"volume":141.98428647420783,"volume_molar":10.688116985698047,"formula_full":"Nb6 Al2","formula_reduced":"Nb3Al","formula_anonymous":"AB3","energy_above_hull":4.4933552500000005,"spacegroup":223},{"id":"jvasp-18926","created_at":"2022-09-04T14:36:40.998002Z","updated_at":"2022-09-04T14:36:40.998029Z","structure_string":"Lu1 S1\n1.0\n3.287235 -0.000000 1.897886\n1.095745 3.099235 1.897886\n0.000000 0.000000 3.795772\nLu S\n1 1\ndirect\n0.000000 0.000000 0.000000 Lu\n0.499998 0.500001 0.500001 S\n","nsites":2,"nelements":2,"elements":["Lu","S"],"chemical_system":"Lu-S","density":8.889988454374993,"density_atomic":0.051718344840915614,"volume":38.670997808455624,"volume_molar":11.644109606608563,"formula_full":"Lu1 S1","formula_reduced":"LuS","formula_anonymous":"AB","energy_above_hull":0.0692378750000002,"spacegroup":225},{"id":"jvasp-102594","created_at":"2022-09-04T14:36:41.917407Z","updated_at":"2022-09-04T14:36:41.917427Z","structure_string":"Zr2 Co6\n1.0\n5.330097 0.000000 0.000000\n-2.665049 4.616000 0.000000\n-0.000000 -0.000000 4.179251\nZr Co\n2 6\ndirect\n0.333333 0.666667 0.750000 Zr\n0.666667 0.333333 0.250000 Zr\n0.151855 0.303710 0.250000 Co\n0.696291 0.848145 0.250000 Co\n0.151855 0.848145 0.250000 Co\n0.848146 0.696291 0.750000 Co\n0.303710 0.151855 0.750000 Co\n0.848146 0.151855 0.750000 Co\n","nsites":8,"nelements":2,"elements":["Zr","Co"],"chemical_system":"Co-Zr","density":8.656707374920336,"density_atomic":0.07780197455073372,"volume":102.82515381127375,"volume_molar":7.740344374001763,"formula_full":"Zr2 Co6","formula_reduced":"ZrCo3","formula_anonymous":"AB3","energy_above_hull":3.4838618,"spacegroup":194},{"id":"jvasp-102127","created_at":"2022-09-04T14:36:41.954016Z","updated_at":"2022-09-04T14:36:41.954041Z","structure_string":"Sm1 Zr1\n1.0\n3.373512 -0.000000 0.000000\n-1.686756 2.921547 -0.000000\n-0.000000 0.000000 5.514109\nSm Zr\n1 1\ndirect\n0.333332 0.666668 0.500000 Sm\n0.000000 0.000000 0.000000 Zr\n","nsites":2,"nelements":2,"elements":["Sm","Zr"],"chemical_system":"Sm-Zr","density":7.38153667347516,"density_atomic":0.03680099086705366,"volume":54.34636277118597,"volume_molar":16.36407232010528,"formula_full":"Sm1 Zr1","formula_reduced":"SmZr","formula_anonymous":"AB","energy_above_hull":2.0262216875,"spacegroup":187}]}