The University of Southampton is offering a prestigious fully-funded 4-year ICASE PhD studentship to explore the potential of Proton-exchange Membrane (PEM) hydrogen fuel cells for sustainable transport and carbon-neutral energy applications. Led by Professor Chris-Kriton Skylaris, the project focuses on utilizing cutting-edge quantum (DFT, DFTB) and classical simulations to analyze the behavior of metallic catalyst nanoparticles crucial for fuel cell efficiency. By developing advanced models through atomistic simulations, the team aims to optimize the performance of these nanoparticles, ultimately working towards building a digital twin of a hydrogen fuel cell. The research will also be transferable to other electrochemical systems like electrolysers. The project involves collaboration with industrial partner Johnson Matthey, providing guidance on relevant models and materials, along with opportunities for placements at their premises. Applicants with a strong background in Physics, Chemistry, or Materials Science are encouraged to apply, especially those with experience in quantum chemistry or solid state electronic structure calculations. The deadline for applications is 31 August 2024. Interested candidates should submit a research proposal, curriculum vitae, degree transcripts/certificates, and two reference letters to Professor Skylaris. The innovative project offers a unique opportunity for aspiring researchers to contribute to the advancement of hydrogen fuel cell technology in the pursuit of sustainable energy solutions.