{"success":true,"data":{"mat_id":"agm020857044","formula":"Ca5Nb3ClO12","summary":{"formula":"Ca5Nb3ClO12","spg":176,"spg_symbol":"P6_3\/m","crystal_system":"hexagonal","point_group":"6\/m","nsites":42,"n_elements":4,"elements":["Ca","Nb","Cl","O"]},"energy":{"e_above_hull":0.027928619,"e_form":-3.2685478,"energy_corrected":-339.2227,"energy_total":-322.36771502},"electronic":{"band_gap_ind":4.1566,"band_gap_dir":4.1577,"dos_ef":0},"magnetic":{"total_mag":0},"structure":{"a":10.80596874,"b":10.805968732858313,"c":6.70659614,"alpha":90,"beta":90,"gamma":120.00000000165043,"volume":678.2037702391369,"n_sites":42},"meta":{"prototype_id":"AB3C5D12_0_spg176","decomposition":" Ca4Nb2O9  Ca2Nb2O7  CaCl2 ","run_timestamp":"2025-01-21 08:59:02"},"composition":{"Ca":10,"Nb":6,"Cl":2,"O":24}}}