PhD Opportunity in Computational Chemistry, Molecular Dynamics, DFT, and Materials Science Walailak University

PhD opportunity at Nanyang Technological University (Singapore) in AI-enabled atomistic modelling of dynamic interfaces in alcohol electro-oxidation . This funded PhD project, supervised by Prof Zhichuan Jason Xu in the School of Materials Science and Engineering , focuses on understanding how catalyst reconstruction and interfacial proton transfer control alcohol electro-oxidation. The research is centered on nickel-based (oxy)hydroxides and aims to reveal how evolving catalyst structures influ...

Postdoctoral Fellowship in the MINIONS project at the University of Aveiro, Portugal. This opening is for 1 postdoctoral fellowship at CICECO - Aveiro Institute of Materials, within the R&D project MINIONS - MImicking NItrogenase-inspired catalysis ON Sulfur-terminated mxenes (reference 2024.16387.PEX). The project sits in the scientific area of Chemistry and spans computational chemistry, surface science, catalysis, and materials-focused modeling. The work plan includes computational studies of...

Postdoctoral Research Associate in Electrocatalysis at the University of Sydney, School of Chemical and Biomolecular Engineering. This is a full-time, fixed-term postdoctoral position for 2 years, based in Darlington, Australia, contributing to externally funded GETCO2 projects and collaborating with experimental researchers. The role focuses on computational electrocatalysis, including first-principles/DFT studies of electrocatalytic reactions, catalyst surfaces and interfaces, reaction mechani...

Research Fellow in Computational Chemistry at the University of Southampton , United Kingdom. This is a postdoctoral opportunity in the School of Chemistry and Chemical Engineering , working as part of the group of Prof. Gill Reid and Em. Prof. John Dyke . The role sits within the EXPRESS Programme Grant (Exploiting Single Source Precursors for the Electrochemical Growth of Functional 1D and 2D Metal Dichalcogenide Semiconductors), a major interdisciplinary EPSRC-funded programme involving South...

Postdoctoral Researcher in computational modelling of battery cathode materials at the University of Oxford , Department of Materials, within Professor Saiful Islam’s group. This post is part of the Faraday Institution-funded 3D-CAT consortium project, “Accelerated Development of Next Generation Li-Rich 3D Cathode Materials.” The Oxford research will focus on lithium battery cathodes , especially Li-rich three-dimensional materials and disordered rock salts, with emphasis on structural, redox, t...