Nonequilibrium Solvent Polarization Effects in Real-Time Electronic Dynamics of Solute Molecules Subject to Time-Dependent Electric Fields: A New Feature of the Polarizable Continuum Model

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Authors: Gabriel Gil, Silvio Pipolo, Alain Delgado, Carlo Andrea Rozzi, Stefano Corni

Journal title: Journal of Chemical Theory and Computation

Journal number: 15/4

Journal publisher: American Chemical Society

Published year: 2019

Published pages: 2306-2319

DOI identifier: 10.1021/acs.jctc.9b00010

ISSN: 1549-9618