Arash Mostofi is Professor of Theory and Simulation of Materials in the Departments of Materials and Physics at Imperial College London. He is the Director of the Centre for Doctoral Training on Theory and Simulation of Materials, and Director of the Thomas Young Centre at Imperial College London.
Arash's research is dedicated to the development and application of first-principles modelling tools for the theory and simulation of materials. He is an original author and developer of two major electronic structure simulation codes, ONETEP and Wannier90, used by hundreds of researchers worldwide. His research interests include defects and interfaces in semiconductors, electron transport in nanowires and nanotubes, and the structure and properties of perovskite oxide thin films.
et al., 2019, Tolerance factor control of uniaxial negative thermal expansion in a layered perovskite, Chemistry of Materials, ISSN:0897-4756
et al., 2019, Attractive electron-electron interactions from internal screening in magic angle twisted bilayer graphene, Physical Review B: Condensed Matter and Materials Physics, ISSN:1098-0121
et al., 2019, Combining embedded mean-field theory with linear-scaling density-functional theory, Journal of Chemical Theory and Computation, ISSN:1549-9618
et al., 2019, Wannier90 as a community code: new features and applications, Journal of Physics: Condensed Matter, ISSN:0953-8984
et al., 2019, Twist-angle sensitivity of electron correlations in moiré graphene bilayers, Physical Review B, Vol:100, ISSN:2469-9950