E. Deiss et al., NUMERICAL-SIMULATION OF THE CYCLIC VOLTAMMOGRAM OF POLYACETYLENE, Journal of the Electrochemical Society, 142(10), 1995, pp. 3256-3262
The measured cyclic voltammogram of a polyacetylene-coated electrode b
athed in an electrolyte solution was simulated numerically for various
scan rates. The model used accounts for a modified Butler-Volmer-type
heterogeneous kinetics at the electrode surface including a lateral i
nteraction term which effects the observed hysteresis behavior. Within
the polymer an electron flux obeying Ohm's law as well as electrolyte
diffusion and migration is considered and Poisson's equation holds fo
r electroneutrality. Donnan partition kinetics describes the flux and
potential at the interface between the polymer and diffusion layer. El
ectrolyte diffusion is considered in the diffusion layer.