I am a postdoc in the group of Prof. Nicola Marzari at EPFL in Switzerland.
Current research interests include:
- methods such as DFT + U and Koopman’s-compliant functionals for addressing errors in density functional theory
- linear-scaling density functional theory
- methods for treating strong correlation such as dynamical mean field theory
- the oxygen-evolving centre of photosystem II
I completed my PhD at the University of Cambridge, supervised by Dr. Daniel Cole and Prof. Mike Payne on methods for accurately simulating organometallic proteins.