Physical Chemistry of Complex Oxides for Energy and Information Technologies
Complex Oxides for Energy and Information Technologies
Research Areas
- Ion transport in materials for energy and information technologies
- Surface reactions on oxide (electro-)catalysts
- Processes at hetero-interfaces, grain boundaries and dislocations in oxides: thermodynamics and kinetics
- Atomistic simulations of point-defect processes in solids and at their extended defects
- Nanoscale effects on ion transport: high-field, strain, interface-proximity, confinement
Research methods
- Nanoscale chemical analysis with Secondary Ion Mass Spectrometry (SIMS)
- Electrochemical Impedance Spectroscopy (EIS)
- Molecular Dynamics (MD) and Molecular Statics (MS) simulations with classical pair potentials
- Density-Functional-Theory (DFT) calculations
- Continuum modelling of transport processes with Finite-Element and Finite-Difference methods
Research Projects
- SFB 917 - Nanoswitches: Direct investigations of ion transport in oxide systems „HfO2, Ta2O5, SrTiO3“
- EPISTORE: Nanoscale materials for high-density energy conversion devices (Horizon 2020 EU-Projekt)
- SPP 1959: Electric field assisted diffusion and sintering of polycrystalline cerium oxide, together with Prof. O. Guillon (IEK-1) and Prof. R. Dunin-Borkowski (ER-C)
- Poisson–Cahn theory, together with Prof. D. S. Mebane, WVU
- Grain boundaries in UO2, together with Dr. F. Brandt (IEK-6) and Prof. J. Mayer (GFE)
- Oxygen surface exchange on CeO2, together with Prof. A. Klein, TUD
- Oxygen diffusion in mixed conducting perovskites, together with Prof. D. C. Sinclair, University of Sheffield
- Oxygen transport in oxides, together with Prof. H. L. Tuller, MIT
- Defects and diffusion in ferroic perovskites
Recent and forthcoming publications
- „Perovskite crystal symmetry and oxygen-ion transport: A molecular-dynamics study of perovskite“
DOI: 10.1039/D1TA06293J - „Faster diffusion of oxygen along dislocations in (La,Sr)MnO3+δ is a space-charge phenomenon“
DOI: 10.1002/ADFM.202105647 - „Nonlinear ion mobility at high electric field strengths in the perovskites SrTiO3 and CH3NH3PbI3“
DOI: 10.1103/PHYSREVMATERIALS.5.105401 - „Electrochemical methods for determining ionic charge in solids“
DOI: 10.1038/s41563-020-0790-9 - „The importance of singly charged oxygen vacancies for electrical conduction in monoclinic HfO2“ (Editor’s Pick)
DOI: 10.1063/5.0036024