On the application of constant electrode potential simulation techniques in atomistic modelling of electric double layers
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DOI: 10.1080/08927022.2017.1279287
Abstract: Abstract This paper presents a brief overview of molecular simulation techniques utilised to simulate the electrode/electrolyte interfaces. We introduce a simple scheme to perform classical molecular dynamics (MD) simulations at constant electrode potential and show… read more here.
Keywords: simulation techniques; electrode; electric double; electrode potential ... See more keywords