Academic Bibliography

Search 200 years of publications by Ghent University researchers.

prof. dr. ir. Louis Vanduyfhuys

Faculty of Engineering and Architecture > Department of Applied physics

ORCID iD: 0000-0001-6747-3388

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- Journal Article
- A1
- open access
Operando modeling of zeolite-catalyzed reactions using first-principles molecular dynamics simulations

Veronique Van Speybroeck (UGent) , Massimo Bocus (UGent) , Pieter Cnudde (UGent) and Louis Vanduyfhuys (UGent)

(2023) ACS CATALYSIS. 13(17). p.11455-11493
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DFT-quality adsorption simulations in metal-organic frameworks enabled by machine learning potentials

Ruben Goeminne (UGent) , Louis Vanduyfhuys (UGent) , Veronique Van Speybroeck (UGent) and Toon Verstraelen (UGent)

(2023) JOURNAL OF CHEMICAL THEORY AND COMPUTATION. 19(18). p.6313-6325
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- Conference Paper
- C3
Applying classical Density Functional Theory to efficiently characterize adsorption of (non-)spherically symmetric guests in MOFs

Vic De Ridder (UGent) and Louis Vanduyfhuys (UGent)

(2022) FrenchMOF2022 : French MOFs, COFs and Porous Polymers conference, Abstracts.
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- C3
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Molecular simulation of alkane and alkene diffusion in nanoporous membranes to allow for an energy-efficient separation

Bernd Schmidt (UGent) , Louis Vanduyfhuys (UGent) and Veronique Van Speybroeck (UGent)

(2022) Faculty of Engineering and Architecture Research Symposium 2022 (FEARS 2022), Abstracts.
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- Conference Paper
- C3
- open access
Force field based GCMC simulation for characterisation of adsorption and separation in MOFs

Siddharth Ravichandran (UGent) , Louis Vanduyfhuys (UGent) and Veronique Van Speybroeck (UGent)

(2022) 2022 French MOFs, COFs and Porous Polymers conference, Abstracts.
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- Journal Article
- A2
- open access
Mechanistic characterization of zeolite-catalyzed aromatic electrophilic substitution at realistic operating conditions

Massimo Bocus (UGent) , Louis Vanduyfhuys (UGent) , Frank De Proft, Bert M. Weckhuysen and Veronique Van Speybroeck (UGent)

(2022) JACS AU. 2(2). p.502-514
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Crystals springing into action : metal–organic framework CUK-1 as a pressure-driven molecular spring

Paul Iacomi, Ji Sun Lee, Louis Vanduyfhuys (UGent) , Kyung Ho Cho, Pierre Fertey, Jelle Wieme (UGent) , Dominique Granier, Guillaume Maurin, Veronique Van Speybroeck (UGent) , Jong-San Chang, et al.

(2021) CHEMICAL SCIENCE. 12(15). p.5682-5687
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Mechanistic insight into the framework methylation of H-ZSM-5 for varying methanol loadings and Si/Al ratios using first-principles molecular dynamics simulations

Stefan A. F. Nastase, Pieter Cnudde (UGent) , Louis Vanduyfhuys (UGent) , Kristof De Wispelaere (UGent) , Veronique Van Speybroeck (UGent) , C. Richard A. Catlow and Andrew J. Logsdail

(2020) ACS CATALYSIS. 10(15). p.8904-8915
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Ab initio enhanced sampling kinetic study on MTO ethene methylation reaction

Simon Bailleul, Karen Dedecker, Pieter Cnudde (UGent) , Louis Vanduyfhuys (UGent) , Michel Waroquier (UGent) and Veronique Van Speybroeck (UGent)

(2020) JOURNAL OF CATALYSIS. 388. p.38-51
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- Journal Article
- A1
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Cation-pi Interactions accelerate the living cationic ring-opening polymerization of unsaturated 2-alkyl-2-oxazolines

Elias Van Den Broeck (UGent) , Bart Verbraeken (UGent) , Karen Dedecker, Pieter Cnudde (UGent) , Louis Vanduyfhuys (UGent) , Toon Verstraelen (UGent) , Kristof Van Hecke (UGent) , Valentin-Victor Jerca (UGent) , Saron Catak (UGent) , Richard Hoogenboom (UGent) , et al.

(2020) MACROMOLECULES. 53(10). p.3832-3846

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