P. Cnudde
Towards an understanding of the role of π-cation interactions in accelerating living cationic ring-opening polymerization of unsaturated alkyl-2-oxazolines
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Poster
Conference / event / venue
Cecam Workshop - Frontiers and challenges of computing metals for biochemical, medical and technological applications
Paris, France
Wednesday, 11 July, 2018 to Friday, 13 July, 2018
Unraveling the preferred reaction pathways in H-ZSM-5 catalyzed alkene cracking
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Poster
Conference / event / venue
XIXth Netherlands' Catalysis and Chemistry Conference (NCCC XIX)
Noordwijkerhout, The Netherlands
Monday, 5 March, 2018 to Wednesday, 7 March, 2018
Stability of carbenium ions in a complex zeolitic environment
Predicting Alkene Cracking Kinetics in Zeolite Catalysts with advanced Molecular Dynamics Techniques
Adsorption energies of isobutene cracking intermediates in zeolites: how accurately can they be determined by first-principle methods
Master of Science in Chemical Engineering
2018
Ab initio study on the mechanism and kinetics of alkene cracking in zeolite catalysts
Analyzing the stability and reactivity of carbenium ion intermediates in H-ZSM-5 catalyzed octene cracking
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Talk
Conference / event / venue
Europacat 2017
Florence, Italy
Sunday, 27 August, 2017 to Thursday, 31 August, 2017
Exploring the nature and reactivity of alkene cracking intermediates in H-ZSM-5 with molecular simulations
ISBN/ISSN:
Talk
Conference / event / venue
XVIIIth Netherlands' Catalysis and Chemistry Conference (NCCC XVIII)
Noordwijkerhout, The Netherlands
Monday, 6 March, 2017 to Wednesday, 8 March, 2017
Adsorption energies of isobutene cracking intermediates in zeolites: how accurately can they be determined by first-principle methods
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