Theoretical Description of Ion Conduction in Disordered Systems: From Linear to Nonlinear Response

Abstract

Abstract The modelling of the ion conduction in disordered systems is analysed from two different perspectives. First, molecular dynamics simulations are employed to extract some basic properties of the hopping dynamics. It turns out that the dynamical processes can be described to a very good approximation as vacancy hopping processes. Second, the information content of nonlinear conductivity experiments, using high electric fields, is elucidated. For this purpose the single-particle dynamics on 1D and 2D model energy landscapes is elucidated numerically and partly analytically. The approaches encompass discrete as well as continuous energy landscapes, yielding complementary results about the dynamics. The impact for the interpretation of experimental data is discussed.