Electrochemistry

Electrochemistry is the discipline investigating relationships between electrical currents and chemical composition change in general.

Well-known electrochemical phenomena, research fields, and applications include the initially discovered galvanism (muscle stimulation through electric currents), electrophysiology (neuroscience), and corrosion. Also, electrochemical material removal methods such as etching and electrochemical machining, material deposition methods like electrodeposition, galvanization and synthesis, and last but not least, fuel cells and batteries.

A variety of approaches can be used for electrochemical modelling. Simple reaction models which assume uniform species concentrations can predict reaction rates depending solely on the electric potential situation. More detailed models solve transport equations for the different kinds of species that are involved in the reactions, and consider their contributions to the rate of the reactions. Equal for all modelling variants, the transport of both ions and charge-neutral reaction components must be modelled before any chemical conversion can take place—regardless if the conversion is of chemical or electrochemical nature.

Simcenter STAR-CCM+ implements electrochemistry models widely generically and based on first principles, to assert their applicability independent of any specific application. For certain applications where tailored solutions provide better results, like the lithium ion battery model, specific solutions exist as well.

You can use the electrochemistry models in Simcenter STAR-CCM+ to determine the evolution of electrochemical reaction rates, currents, species concentrations, and fluxes, or to investigate derived parameters like the ionic space charge density.