Office Address: S05 V06 E78
Office number: +49 (0) 201 183-2992
Scholar: https://scholar.google.com/citations?hl=de&user=i6og1jMAAAAJ
Orcid: https://orcid.org/0000-0003-2934-6075
Scopus: https://www.scopus.com/authid/detail.uri?authorId=56501788200
Twitter: https://twitter.com/ExnerKai
Kai S. Exner
Head
I am a physical electrochemist with a particular interest in the theoretical investigation of proton-coupled electron transfer steps relevant to energy conversion and storage. My group applies a variety of different computational techniques, ranging from electronic structure calculations in the density functional theory approximation to ab initio molecular dynamics simulations and data-driven approaches, to gain insights into charge transfer processes at electrified solid/ liquid interfaces. These methods are used to model to a variety of different electrode materials under applied bias, such as two-dimensional materials, transition-metal oxides, transition-metal sulfides, and single-atom catalysts.