Propensity of hydroxide and hydronium ions for the air–water and graphene–water interfaces from <i>ab initio</i> and force field simulations

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Authors: Laura Scalfi, Louis Lehmann, Alexandre P. dos Santos, Maximilian R. Becker, Roland R. Netz

Journal title: The Journal of Chemical Physics

Journal number: 161

Journal publisher: American Institute of Physics

Published year: 2025

Published pages: 144701

DOI identifier: 10.1063/5.0226966

ISSN: 0021-9606