Prof. Dr. ir. Veronique Van Speybroeck
High-throughput screening to predict the textural and adsorption properties of covalent organic frameworks using a top-down approach
From data science to physical insight: systematically identifying the collective variables describing phase transformations in flexible materials
Designing 2D hybrid organic-inorganic perovskites for game-changing photovoltaics
Master of Science in Engineering Physics
2018
Constructing accurate coarse-grained force fields by variational minimization: The subtle balance between accuracy and sparseness
Master of Science in Engineering Physics
2018
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
Modeling the reactivity and selectivity of chemical reactions with advanced molecular modeling methods
Thu, 28/09/2017
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
Derivation and application of a reliable procedure to computationally model the mechanical stability of rigid and flexible metal-organic frameworks
Fri, 25/05/2018
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
Unraveling Reaction Mechanisms of Chemical Reactions in Solvents Using Advanced Molecular Modeling Tools
Fri, 19/05/2017
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
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