Polarizable Embedding for Excited-State Reactions: Dynamically Weighted Polarizable QM/MM.
Sign Up to like & getrecommendations! Published in 2018 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.8b00064
Abstract: Recent interest in polarizable embedding methods for electronic excited states has so far been focused on optical absorption and emission spectra calculations. To explore the suitability of these methods for excited-state reactions, we constructed a… read more here.
Keywords: excited state; weighted polarizable; dynamically weighted; polarizable embedding ... See more keywords