Staff Lead researchers Professor Chris Skylaris Professor of Computational Chemistry Research interests Development of large-scale electronic structure methods, based on Density Functional Theory w… Development of atomistic and multiscale simulation methods for materials using quantum and cl… Application of these simulation methods to discover advanced materials in technologically rel… Connect with Chris Email: C.Skylaris@soton.ac.uk Collaborating research institutes, centres and groups Computational Systems Chemistry Our research covers a broad range of domains from nanoscale materials properties, atmospheric chemistry, through to biological systems. Research outputs