Past events

The 19th International Conference on Density Functional Theory and its Applications will be held in Brussels this year. For detailed information you can visit https://www.dft2022.be/. Hope to see you all there! 

Prof. Dr. Christel Gervais from Sorbonne Université (France) will present a research seminar titled: "Probing local environments in materials by combining NMR and DFT calculations". 

Prof. Dr. Fernanda Duarte from the University of Oxford (UK) will present a research seminar titled: "Exploring reaction mechanisms through automation and machine learning". 

Prof. Dr. Frédéric Guégan from Université de Poitiers (France) will present a research seminar titled: "Theoretical aspects of reactivity and selectivity: chosen examples from molecular chemistry" 

Prof. Dr. Scott Habershon from the University of Warwick (UK) will present a research seminar titled: "Reaction mechanism discovery using random walks in chemical space" 

Dr. Daria Galimberti from the Radboud University Nijmegen (The Netherlands) will present a research seminar titled: "DFT-MD simulations and Vibrational Spectroscopy: what we can learn" 

Prof. Dr. Monica Calatayud from Sorbonne Université (France) will present a research seminar titled: "Modelling H2 interaction with metal oxides: computational approaches for surface reactivity" 

Prof. Dr. Christophe Morell from the Université de Lyon (France) will present a research seminar titled: "How can excited states help understand the chemical reactivity and selectivity?" 

Prof. Dr. Katarzyna Pernal from the Lodz University of Technology (Poland) will present a research seminar titled: "On-top pair density dynamic correlation energy functional for ground and excited states" 

Prof. Dr. Jérôme Loreau from KU Leuven (Belgium) will present a research seminar titled: "Statistical approaches to ion-molecule reactions" 

Prof. Dr. Remco Havenith from the Rijksuniversiteit Groningen (The Netherlands) will present a research seminar titled: "A view on chemical bonding" 

Prof. Dr. Trevor Hamlin from the Vrije Universiteit Amsterdam (The Netherlands) will present a research seminar titled: "Understanding Chemical Reactivity Using the Activation Strain Model"