Computational study of spectroscopic and thermodynamic properties of molecular complexes

Description of the research topic

Molecular complexes are the simplest chemical objects which allow us to study molecular interactions. Our aim is to compute spectroscopic and thermodynamic properties of small complexes by means of variational and path-integral methods. This project requires further development of these methods, derivation of simple relationships using group theoretical considerations, development of analysis tools for floppy, delocalized systems, and performing large-scale computations.

Thesis supervisor: Edit Mátyus

Required language skills: English

How to Apply?

If you are interested apply here: [PhD] György Hevesy Doctoral School of Chemistry – Eötvös Loránd University (elte.hu)

For more information visite the following website: György Hevesy Doctoral School of Chemistry (elte.hu)

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