Veronique Van Speybroeck

86PUBLICATIONS
256CO-AUTHORS
Theory and design of materialsTheoretical quantum chemistrySeparation technologiesComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Structure and dynamics of materials
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Publications (86)

|Oct 09, 2026
Enhancing Solubility Predictions of Plastic Additives in Depolymerization Solvents Using Quantum Chemical Conformer Analysis and COSMO-RS.

|Aug 28, 2026
The catalysed electrophilic aromatic bromination of benzenes: insights from density functional theory and biased molecular dynamics simulations.

|Jul 31, 2026
Engineering adsorption selectivity in MFI zeolites through suppression of silanol-driven water competition for efficient acetone capture.

|Jun 04, 2026
A Novel NPT Thermodynamic Integration Scheme to Derive Rigorous Gibbs Free Energies for Crystalline Solids.

|May 07, 2026
A consistent dynamics view on nanoporous catalysts in action across length and time scales.

|Mar 03, 2026
Diamine Grafting of Pyrazole-Based MOF-303 for Diluted-Source CO2 Capture.

Giuseppe Mastronardi, Jacopo Perego, Charl Xavier Bezuidenhout

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Frequent Collaborators

18 joint publications

Sven M J Rogge

10 joint publications

Jelle Wieme

9 joint publications

Pascal Van Der Voort

9 joint publications

Massimo Bocus