PhD Position in Computational Materials Science and Energy Applications University of Alcalá in Spain

PhD opening in Zaragoza, Spain at the Instituto de Nanociencia y Materiales de Aragón (INMA), CSIC/Universidad de Zaragoza . The project focuses on porous organic cages as programmable molecular environments for solar-energy conversion . Research topics include quantum chemistry , molecular dynamics , and machine learning to predict photophysical properties, with emphasis on photoinduced electron transfer and singlet fission for next-generation solar materials. Eligibility highlights: an M.Sc. i...

University of Liverpool, United Kingdom is recruiting two Postdoctoral Research Associates for a 1-year fixed-term project in computational discovery of new materials for electromagnetic shielding . The research sits in a highly collaborative, multidisciplinary programme focused on the computational design and prediction of novel inorganic materials. Current areas of interest include magnetic MXenes and large-unit-cell magnetic hexaferrites , with strong encouragement for applicants working in r...

Julio Lloret Fillol at the Institute of Chemical Research of Catalonia (ICIQ) announces two upcoming funded openings: a 4-year PhD position and a 3-year postdoctoral position. The project focuses on AI-driven robotics for catalyst discovery, with research directions including AMPER, CO₂-to-fuels, green H₂, high-throughput electrochemistry, and closed-loop optimization. This is a strong fit for candidates interested in chemistry, chemical engineering, materials science, robotics, and computationa...

🔬 The Institute of Nanoscience and Materials of Aragón (INMA), Zaragoza, Spain, is advertising a fully funded PhD position in Computational Chemistry . The project sits at the interface of molecular photophysics , quantum chemistry , molecular dynamics , machine learning , and materials science . The research will focus on porous organic cages (POCs) for solar-energy conversion , aiming to understand and predict their photophysical properties using computational and data-driven methods. Eligibil...

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...