Artificial Intelligence and QM/MM with a Polarizable Reactive Force Field for Next-Generation Electrocatalysts

Authors: Saber Naserifar, Yalu Chen, Soonho Kwon, Hai Xiao, William A. Goddard

Published: 2020-11-27

DOI: 10.1016/j.matt.2020.11.010

Source: Full article


Abstract

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