Next seminar
Computational Heterogeneous Catalysis in an Innovation Context: Cases of Platinum-based and Zeolite Catalysts
Heterogeneous catalysts are key players in the current energy transition. The structure of their active sites and the mechanisms they catalyze remain the subject of intense debate. Atomic-scale calculations can help decipher these aspects when combined with relevant characterization techniques and kinetic measurements. In this talk, I will illustrate recent insights gained from density functional theory calculations into the behavior of protonic zeolite catalysts and of platinum-based catalysts supported on …