Postdoctoral Researcher in High-Throughput Screening of Catalytically Active High Entropy Oxides Institut de Recherche sur les Céramiques (CNRS) in France

Immediate postdoctoral researcher openings are available in the group of Shyam Kattel at the University of Central Florida . The position is centered on theoretical heterogeneous catalysis and the modeling of electrochemical reactions on surfaces and interfaces . Successful candidates should bring experience in first-principles density functional theory (DFT) , grand canonical DFT (GC-DFT) , microkinetic modeling , kinetic Monte Carlo simulations , and machine learning methods . The group also v...

PhD opportunity in battery modelling, electrochemical interfaces, atomistic modelling, first-principles simulations, and machine-learned interatomic potentials at CIC energiGUNE in Vitoria-Gasteiz, Spain . The Modelling and Simulation group is recruiting a PhD candidate for e-ChemIn , a Marie Skłodowska-Curie Actions Doctoral Network focused on understanding and engineering electrochemical interfaces for next-generation energy technologies. The selected doctoral candidate will study how buried e...

The PACE Lab (Predictive Atomistic Computations for Electrochemistry) in the Department of Mechanical Engineering at The University of Tennessee at Chattanooga is recruiting for two opportunities: a Postdoctoral Researcher and a funded M.S. position . The postdoctoral project focuses on machine learning interatomic potentials (MLIPs) for electrochemistry , with applications to electrochemical interfaces and energy materials . Strong candidates will have experience in DFT , molecular dynamics , m...

University at Buffalo is hiring a Postdoctoral Associate in Agentic AI × Computational Catalysis within the Peng Research Group . The position sits at the intersection of scientific AI , first-principles atomistic simulations , computational catalysis , and data-driven materials discovery , with primary support for the DOE Genesis Mission project. The postdoc will also benefit from access to world-class AI computing through Empire AI and collaboration with a multi-institutional DOE team. This op...

Postdoctoral opportunity in catalysis , chemical engineering , and materials science at the Institut des Sciences Chimiques de Rennes (ISCR) , hosted by ENS Chimie de Rennes . The project focuses on the design of innovative 3D-printed catalysts for the selective catalytic hydrogenation of biomass-derived compounds . The target substrates include unsaturated aldehydes such as citral and fatty esters , with the goal of producing high-value products for the fine chemistry and fragrances industries....