Full-time Assistant and PhD Position in Computational Chemistry, Photocatalysis, Organic Electronics, or Quantum Information Science University of Namur in Belgium

Monash University is advertising a double PhD degree opportunity with the University of Bayreuth for a project on accelerating organic semiconductor discovery with generative AI, molecular dynamics, and density functional theory (DFT) . The research sits at the intersection of materials science , computational chemistry , scientific machine learning , and physics , with a focus on designing next-generation organic semiconductor materials with tailored optoelectronic properties. The program is pa...

PhD opportunity in computational chemistry at the University of the Basque Country (EHU) , within the Theoretical Chemistry group supervised by Dr Daniel Reta . The project focuses on organic radicals and single electron transfer in Lewis pairs , with the goal of creating new organic radicals. The research uses advanced electronic structure and simulation tools including DFT , multireference methods , QM/MM , and molecular dynamics , and includes access to the Hyperion supercomputer at DIPC . Th...

CEA-Saclay SPEC/LEPO is advertising a funded M2 internship with the possibility to continue into a fully funded PhD starting in Fall 2027 . The project is centered on the preparation and characterization of molecular networks and their evolution under light, with a focus on on-surface photochemistry . This is a strong fit for students interested in photophysics , photochemistry , physics/optics , surface science, and light-driven molecular processes. The opportunity is posted by Nicolas Fabre at...

Postdoctoral position available at Kangwon National University in the Department of Geology , working with the Geological Molecular Science (GeMS) Group led by Dr. Kideok Kwon . The project focuses on mineral-fluid interfaces and mineral-water interface research , with emphasis on atomic-scale structures, properties, geochemical processes, interfacial reactivity, and isotope-fractionation processes. The role involves supercomputer-based Density Functional Theory (DFT) calculations, Molecular Dyn...

Two fully funded 3-year PhD positions are available at the University of Vienna in coupled-cluster theory development , with a focus on strong electron correlation and applications to challenging compounds. The positions are embedded in Prof. Leticia González’s group, offering a research environment with opportunities to interact with experts in semiclassical nonadiabatic dynamics , photocatalysis , and related areas. The work is guided by Pavel Pokhilko, and the post highlights mentoring and ca...