Discovery of Conical Intersection Mediated Photochemistry with Growing String Methods

Phys. Chem. Chem. Phys., 2018, Accepted Manuscript DOI: 10.1039/C8CP04703K, PaperCody Aldaz, Joshua Kammeraad, Paul Zimmerman Conical intersections (CIs) are important features of photochemistry that determine yields and selectivity. Traditional CI optimizers require significant human effort and chemical intuition, which typically restricts searching to only a... The content of this RSS Feed (c) The Royal Society of Chemistry

Source: RSC - Phys. Chem. Chem. Phys. latest articles - October 17, 2018 Category: Chemistry Authors: Cody Aldaz Source Type: research