https://iochem-bd.bsc.es/browse/handle/100/492992 Open_Shell_DFT 2026-04-29T16:21:05Z https://iochem-bd.bsc.es/browse/handle/100/493039 Title: /Radical_Abstractions/XAT TS_XAT Authors: Funes, Ignacio Abstract: Transition State 2026-04-20T09:27:45Z https://iochem-bd.bsc.es/browse/handle/100/493040 Title: /Radical_Abstractions/XAT/IRC IRC_forward Authors: Funes, Ignacio Abstract: Checking the nature of the TS 2026-04-20T09:27:45Z https://iochem-bd.bsc.es/browse/handle/100/493041 Title: /Radical_Abstractions/XAT/IRC IRC_reverse Authors: Funes, Ignacio Abstract: Checking the nature of the TS 2026-04-20T09:27:45Z https://iochem-bd.bsc.es/browse/handle/100/493038 Title: /Radical_Abstractions/XAT add1_XAT Authors: Funes, Ignacio Abstract: Optimization 2026-04-20T09:27:45Z