Dear Sir/Mam Greetings, This is Muthu, from Anna University India. I want to do Nudged elastic band (NEB) calculation in SIESTA, to find the transition state in the reaction coordinate profile. Please anyone help me to do the calculation.
Thank you best regards Muthu.
-- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence (http://www.max-centre.eu/)
