Imperial College London


Faculty of EngineeringDepartment of Materials

Chair in Materials Design



+44 (0)20 7594 1178a.walsh Website




2.10Royal School of MinesSouth Kensington Campus





Aron Walsh is a Full Professor and Fellow of the RSC in the Department of Materials. He leads the Materials Design Group at Imperial College and holds a dual Underwood Distinguished Professorship at Yonsei University, Korea.

Aron was awarded his PhD from Trinity College Dublin. He then worked for the US Department of Energy at the National Renewable Energy Laboratory (NREL), followed by a Marie Curie Fellowship hosted by University College London, and a Royal Society University Research Fellowship held at the University of Bath.

His research involves cutting-edge materials theory and simulation applied to problems across solid-state chemistry and physics, including materials for solar cells and fuels, batteries, thermoelectrics, and solid-state lighting. He has an expertise in the theory of semiconductors and dielectrics, and is developing innovative solutions for materials data, informatics and design. His group published a review on machine learning for molecules and materials in Nature. 

These activities have been supported by funding from the Royal Society, EPSRC, ERC, Horizon2020, and the Faraday Institution

In 2015, Aron was awarded the EU-40 prize from the European Materials Research Society and the Chemistry Society Reviews Emerging Investigator Lectureship for his work on the theory of next-generation perovskite photovoltaics. In 2017, he was a recipient of the Philip Leverhulme Prize. In 2019, he received the Corday-Morgan Prize from the RSC for his breakthrough research on hybrid organic-inorganic solids.

Aron features in the Highly Cited Researchers list. A full publication list can be found on Google Scholar.

Scientific Editor

Royal Society of Chemistry: Materials Horizons

Editorial Advisory Boards

American Chemical Society: ACS Energy Letters

Institute of Physics: JPhys Energy

Royal Society of Chemistry: Sustainable Energy & Fuels

American Institute of Physics: APL Materials



Kim S, Hood S, Park J, et al., 2020, Quick-start guide for first-principles modelling of point defects in crystalline materials, Journal of Physics: Energy

Park J-S, Li Z, Wilson JN, et al., 2020, Hexagonal Stacking Faults Act as Hole-Blocking Layers in Lead Halide Perovskites, Acs Energy Letters, ISSN:2380-8195, Pages:2231-2233

Rahim W, Skelton J, Savory C, et al., 2020, Polymorph Exploration of Bismuth Stannate Using First-principles Phonon Mode Mapping

YANG H, Savory C, Morgan B, et al., 2020, Chemical Trends in the Lattice Thermal Conductivity of Li(Ni,Mn,Co)O<sub>2</sub> (NMC) Battery Cathodes

Golomb M, Calbo J, Bristow JK, et al., 2020, Ligand Engineering in Cu(II) Paddle Wheel Metal-Organic Frameworks for Enhanced Electrical Conductivity

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