Stability of carbenium ions in a complex zeolitic environment
Master of Science in Chemical Engineering
2019
Prof. Dr. ir. Veronique Van Speybroeck
Influence of topology, nature of the active site and operating conditions on the formation and growth of aromatics in zeolites
Master of Science in Chemical Engineering
2019
Predicting alkene cracking kinetics in zeolite catalysts with advanced molecular dynamics techniques
Operando First Principle Simulations of Important Chemical Transformations over Zeolites within the Methanol-to-Olefin Process
Wed, 18/12/2019
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
Supervisors
Prof. Dr. ir. Veronique Van SpeybroeckTowards a Molecular Level Understanding of Active Sites for Catalysis and the Interactions with Solvents in Zirconium Based Metal-Organic Frameworks at Operating Conditions
Unraveling the meaning of time in coarse-grained molecular dynamics simulations to study diffusion in heterogeneously disordered MOFs
Nanofibers for drug delivery: Modelling Polymer-Drug interaction, how to obtain the most stable yet most drug releasing formula
Master of Science in Chemical Engineering
2020
Understanding Noncovalent Interactions in Force Fields through Quantum Mechanics: Application to Gas Adsorption in Metal-Organic Frameworks
Wed, 08/05/2019
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
Efficient and accurate construction of free energy profiles for flexible metal-organic frameworks through enhanced sampling molecular dynamics simulations
Wed, 20/02/2019
Ghent University AULA, Voldersstraat, Ghent
Supervisors
Prof. Dr. ir. Veronique Van SpeybroeckAdvanced Molecular Simulations to Study Defects and Nature of Active Sites in Zirconium Based Metal-Organic Frameworks for Catalysis
Wed, 23/05/2018
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
Supervisors
Prof. Dr. ir. Veronique Van SpeybroeckPages
