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Elsevier, Journal of Computational Physics, (235), p. 764-785

DOI: 10.1016/j.jcp.2012.08.043

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A computational approach for the simulation of natural convection in electrochemical cells

Journal article published in 2013 by Andreas Ehrl, Georg Bauer, Volker Gravemeier, Wolfgang A. Wall ORCID
This paper is available in a repository.
This paper is available in a repository.

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Abstract

A novel computational approach for the numerical simulation of electrochemical systems influenced by natural convection phenomena is presented. A stabilized finite element framework for multi-ion transport mechanisms including convection, diffusion and migration coupled to an incompressible flow solver is developed. The role of a galvanostatic Butler-Volmer condition including the interaction of ionic concentration at the surface of the electrode and the surface overpotential is emphasized, to obtain a non-uniform surface overpotential distribution. Additionally, a threedimensional rotationally-symmetric boundary condition is used for modeling rotating cylinder electrodes. The computational framework is tested for various numerical examples exhibiting two- and three-dimensional electrochemical cell configurations including dilute CuSO 4 electrolytes with and without excess of supporting H 2 SO 4 electrolyte.