{"success":true,"data":{"mat_id":"agm010405301","formula":"Ca4La3Zr2Sc(NiO5)4","summary":{"formula":"Ca4La3Zr2Sc(NiO5)4","spg":1,"spg_symbol":"P1","crystal_system":"triclinic","point_group":"1","nsites":34,"n_elements":6,"elements":["Ca","La","Zr","Sc","Ni","O"]},"energy":{"e_above_hull":0.12603791,"e_form":-2.753212,"energy_corrected":-262.1272,"energy_total":-239.42539374},"electronic":{"band_gap_ind":0,"band_gap_dir":0.0105,"dos_ef":23.311117},"magnetic":{"total_mag":5.9602613},"structure":{"a":5.547103410377505,"b":5.566527800083944,"c":14.701756808062063,"alpha":89.32465822669309,"beta":80.8359363441084,"gamma":89.76005738372491,"volume":448.1358184879233,"n_sites":34},"meta":{"prototype_id":"AB2C3D4E4F20_0_spg38","decomposition":" LaO2  CaO8  CaZrO3  Ca2ZrO4  Sc2O3  NiO ","run_timestamp":"2024-06-24 11:39:00.587138"},"composition":{"Ca":4,"La":3,"Zr":2,"Sc":1,"Ni":4,"O":20}}}