Laboratory of Electrochemical Energy

Our research interests are related to computer modeling of heterogeneous systems and processes at the atomic (molecular) level. Methods such as classical molecular dynamics, quantum chemical modeling, and the PIC (particle-in-cell) method make up the main arsenal of methods we use. Key areas of research:

The structure of the electrode/electrolyte interface in application to electrochemical current sources;

Heterogeneous electron transfer and ion intercalation;

The phenomena of partial charge transfer between the surface and the adsorbate in the context of gas sensors;

Plasma separation of spent nuclear fuel (spent nuclear fuel);

Chemistry of defects in a solid (surface segregation, diffusion).