Hi all, I am interested in running metadynamics using Quantum Espresso patched with the metadynamics code Plumed.
My question is if Quantum Espresso can tell Plumed to perform the metadynamics exploration on a Excited Electronic State, rather than on the Ground State. From what I saw in the documentation, it seems it can't be done, but I would like some confirmation. Many thanks in advance! With best regards, -- Juan Manuel Ortiz S?nchez, Ph. D. Postdoctoral Researcher, Prof. David Coker's Group Department of Chemistry Boston University -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140918/cea4dcdf/attachment.html
