Members of the Centre for Computational Chemistry
The Members of the Centre are:
- Prof Neil Allan
Director of the Centre for Computational Chemistry
Computational materials chemistry - Prof Gabriel Balint-Kurti (Emeritus)
Quantum dynamics and reactive scattering - Dr Natalie Fey (EPSRC Advanced Research Fellow)
Computational inorganic chemistry - Dr Scott Habershon (Leverhulme Trust Early Career Fellow)
Condensed-phase quantum dynamics - Prof Jeremy Harvey
Electronic structure and reactivity - Prof Fred Manby
Electronic structure method development - Prof Adrian Mulholland (EPSRC Leadership Fellow)
Computational enzymology - Dr Paddy Royall (Royal Society University Research Fellow)
Colloid dispersions - Prof Dudley Shallcross
Computational atmospheric chemistry - Dr David Tew (Royal Society University Research Fellow)
Electronic structure and dynamics
Associate Members are:
- Prof Roger Alder FRS
Computational organic chemistry - Prof Richard Dixon FRS
Quantum dynamics of reactive processes - Simon McIntosh-Smith
High performance computing and multicore architectures - Dr Colin Western
Electronic gas-phase spectroscopy