Nonlinear phase-field model for electrode-electrolyte interface evolution

Phys Rev E Stat Nonlin Soft Matter Phys. 2012 Nov;86(5 Pt 1):051609. doi: 10.1103/PhysRevE.86.051609. Epub 2012 Nov 26.

Abstract

A nonlinear phase-field model is proposed for modeling microstructure evolution during highly nonequilibrium processes. We consider electrochemical reactions at electrode-electrolyte interfaces leading to electroplating and electrode-electrolyte interface evolution. In contrast to all existing phase-field models, the rate of temporal phase-field evolution and thus the interface motion in the current model is considered nonlinear with respect to the thermodynamic driving force. It produces Butler-Volmer-type electrochemical kinetics for the dependence of interfacial velocity on the overpotential at the sharp-interface limit. At the low overpotential it recovers the conventional Allen-Cahn phase-field equation. This model is generally applicable to many other highly nonequilibrium processes where linear kinetics breaks down.

Publication types

  • Research Support, U.S. Gov't, Non-P.H.S.

MeSH terms

  • Computer Simulation
  • Crystallization / methods*
  • Electrodes*
  • Electrolytes / chemistry*
  • Electromagnetic Fields
  • Electroplating / methods*
  • Models, Chemical*
  • Models, Molecular*
  • Nonlinear Dynamics*
  • Phase Transition
  • Surface Properties

Substances

  • Electrolytes