💻 Research interests : Molecular simulation (DFT, MD), Heterogeneous Catalysis, Cluster and Nanopartice configurations. Scientific code development.

📚 Preferred teaching areas : Process Dynamics and Control, Reactor design and Transport Phenomena, Heterogeneous Catalysis, Organic Chemistry, and Electronic structure and chemical reactivity. 

🗂️ Current personal projects :

• H2 interaction with Ni clean an covered surfaces and nanoparticles (manuscript)

• StegoPlot: package for ab-initio molecular thermodynamics, analysis of DFT results, Densities of states and construct reaction energy plots (python module + LaTeX article, check repository here)

• Webapp for the construction of surface slab models of different sizes/shapes and nanoparticle models of different structure and sizes.

• 3D modelling of chemical systems and laboratory equipment (artistic / pedagogic models).

And some more things here.