PhD (M/F) Investigation of the H2 adsorption capactity by MXenes through atomistic simulations and Machine Learning
The French National Centre for Scientific Research (CNRS)
France
Summary
PhD position in theoretical chemistry focusing on MXenes for hydrogen storage. Combine DFT and neural-network atomic potentials to screen structures, study physisorption and chemisorption, H2 dissociation, and hydride formation. Collaborative work with experimental teams and conferences.
