1968 Professor of Chemistry

I joined the Department in 2020 as the 1968 Professor of Chemistry. See the following link for more information.

Our research involves computer simulations of catalytic and environmental interfaces, aiming at reaching fundamental new understanding of elementary processes at such interfaces. As part of our work, we also seek to develop and improve current simulations methods (quantum and classical) to study such systems. For further information on our research interests see our group web pages.

Positions are availabe for talented students (Part III, masters and PhD) and post-docs interested in joining the group. Interested candidates are encouraged to get in touch -- further information on how to do this can be found here

Biography

Angelos Michaelides obtained a PhD in Theoretical Chemistry in 2000 from The Queen's University of Belfast. Following this, he worked as a post-doctoral research associate and junior research fellow at the University of Cambridge and then at the Fritz Haber Institute, Berlin as an Alexander von Humboldt research fellow and subsequently research group leader. Between 2006 and 2020 he was at University College London where he was Director and Co-Director of the Thomas Young Centre: The London Centre for the Theory and Simulation of Materials and the founding Director of the Materials and Molecular Modelling Hub. Since 2020 he has been the 1968 Professor of Chemistry at the University of Cambridge.

Professor Michaelides discusses his research

Publications

Hydrogen bonds and van der waals forces in ice at ambient and high pressures.
B Santra, J Klimeš, D Alfè, A Tkatchenko, B Slater, A Michaelides, R Car, M Scheffler
Phys Rev Lett
(2011)
107
Acetone adsorption on ice investigated by X-ray spectroscopy and density functional theory.
DE Starr, D Pan, JT Newberg, M Ammann, EG Wang, A Michaelides, H Bluhm
Physical chemistry chemical physics : PCCP
(2011)
13
Proton ordering in cubic ice and hexagonal ice; a potential new ice phase-XIc
Z Raza, D Alfè, CG Salzmann, J Klimeš, A Michaelides, B Slater
Phys Chem Chem Phys
(2011)
13
Large variation of vacancy formation energies in the surface of crystalline ice
M Watkins, D Pan, EG Wang, A Michaelides, J VandeVondele, B Slater
Nature materials
(2011)
10
Quantum nature of the hydrogen bond
A Michaelides
Acta Crystallographica Section A: Foundations and advances
(2011)
67
Adsorption and diffusion of water on graphene from first principles
J Ma, A Michaelides, D Alfè, L Schimka, G Kresse, E Wang
Physical Review B
(2011)
84
Trends in water monomer adsorption and dissociation on flat insulating surfaces.
XL Hu, J Carrasco, J Klimeš, A Michaelides
Physical chemistry chemical physics : PCCP
(2011)
13
Initial stages of salt crystal dissolution determined with ab initio molecular dynamics.
L-M Liu, A Laio, A Michaelides
Phys Chem Chem Phys
(2011)
13
Van der Waals density functionals applied to solids
J Klimeš, DR Bowler, A Michaelides
Physical Review B Condensed Matter and Materials Physics
(2011)
83
Melting the Ice: On the Relation between Melting Temperature and Size for Nanoscale Ice Crystals
D Pan, L-M Liu, B Slater, A Michaelides, E Wang
ACS nano
(2011)
5

Head of group

Research Interest Group

Telephone number

01223 336314

Email address