PhD Position in Ab initio Catalyst Design for Biomass Conversion at Wageningen University & Research Wageningen University & Research in Netherlands

PhD position in nitrogen valorization in high-temperature electrochemical cells at the Dutch Institute for Fundamental Energy Research (DIFFER) , with the work location at TU Eindhoven in the Netherlands. The project focuses on sustainable ammonia production using renewable electricity and advanced electrochemical routes. Research topics include electrochemistry , materials science , catalysis , solid oxide electrochemical cells (SOEC/SOFC), and protonic ceramic electrochemical cells (PCEC/PCFC)...

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...

PhD opportunity in Computational Molecular Modelling and Catalysis at Jilin University, China , with a planned start date of 1 September 2027 . The position is in Professor Sudip Pan 's research group and focuses on research in computational chemistry , molecular modelling , and catalytic systems . The post highlights opportunities to build expertise in modelling approaches applied to catalysis and related chemical physics/materials science topics. Funding: The PhD is fully funded through the Ch...

Postdoctoral position available on DOE Genesis and ARPA-e projects focused on accelerating materials design for catalysis , ionic conductors , and general materials synthesis . The opportunity is associated with Lawrence Berkeley National Laboratory and appears to be part of research led by Anubhav Jain . This is a strong fit for candidates with interests in computational or data-driven materials discovery, catalyst development, solid-state ionics, and synthesis-oriented materials research. No d...

PhD opening at Delft University of Technology (TU Delft) in the Computational Materials Science section, working on hydrogen embrittlement , circular steels , atomistic simulation , density functional theory (DFT) , molecular dynamics (MD) , and machine-learned interatomic potentials . The project, CIRHY (Circularity as Opportunity: Engineering Hydrogen-Resistant Circular Steels), aims to develop next-generation recycled steels that can safely operate in hydrogen environments. The research focus...