{"success":true,"data":{"mat_id":"agm008918862","formula":"Ba2Nb6BBr17","summary":{"formula":"Ba2Nb6BBr17","spg":87,"spg_symbol":"I4\/m","crystal_system":"tetragonal","point_group":"4\/m","nsites":26,"n_elements":4,"elements":["Ba","Nb","B","Br"]},"energy":{"e_above_hull":0.09635343,"e_form":-1.1043429,"energy_corrected":-128.09325,"energy_total":-128.09325233},"electronic":{"band_gap_ind":0.1366,"band_gap_dir":0.1637,"dos_ef":13.210437},"magnetic":{"total_mag":2.2871258},"structure":{"a":10.013151037417813,"b":10.013151030896175,"c":12.215545692809975,"alpha":52.49173959341185,"beta":127.50826041327421,"gamma":118.11684482066629,"volume":760.8101628633233,"n_sites":26},"meta":{"prototype_id":"AB2C6D17_0_spg87","decomposition":" Nb3Br7  Nb3Br8  BaBr2  NbB ","run_timestamp":"2024-12-25 18:55:04"},"composition":{"Ba":2,"Nb":6,"B":1,"Br":17}}}