Research Explorer

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Researcher

Pieter Cnudde

Awards & Distinctions

20 Results

2025

Computational modeling of the mobility, stability, and al positioning ability of cyclic cationic organic structure-directing agents in AEI Zeolite

Pau FerriPieter CnuddeManuel MolinerVeronique Van SpeybroeckMercedes Boronat

A2 Journal Article in JACS AU

2024

In-depth thermodynamic and kinetic analysis of ethane diffusion in ZIF-8

Bernd SchmidtPieter CnuddeVeronique Van SpeybroeckLouis Vanduyfhuys

A1 Journal Article in JOURNAL OF PHYSICAL CHEMISTRY C

2023

Operando modeling of zeolite-catalyzed reactions using first-principles molecular dynamics simulations

Veronique Van SpeybroeckMassimo BocusPieter CnuddeLouis Vanduyfhuys

A1 Journal Article in ACS CATALYSIS

Universal descriptors for zeolite topology and acidity to predict the stability of butene cracking intermediates

Pieter CnuddeMichel WaroquierVeronique Van Speybroeck

A1 Journal Article in CATALYSIS SCIENCE & TECHNOLOGY

2021

Acidity effect on benzene methylation kinetics over substituted H-MeAlPO-5 catalysts

Magnus MorténTomás Cordero-LanzacPieter CnuddeEvgeniy A. RedekopStian SvelleVeronique Van SpeybroeckUnni Olsbye

A1 Journal Article in JOURNAL OF CATALYSIS

Coordination and activation of nitrous oxide by iron zeolites

Max L. BolsBenjamin E. R. SnyderHannah M. RhodaPieter CnuddeGhinwa FayadRobert A. SchoonheydtVeronique Van SpeybroeckEdward I. SolomonBert F. Sels

A1 Journal Article in NATURE CATALYSIS

Experimental and theoretical evidence for the promotional effect of acid sites on the diffusion of alkenes through small‐pore zeolites

Pieter CnuddeEvgeniy A. RedekopWeili DaiNatale G. PorcaroMichel WaroquierSilvia BordigaMichael HungerLandong LiUnni OlsbyeVeronique Van Speybroeck

A1 Journal Article in ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Mobility and reactivity of Cu+ species in Cu-CHA catalysts under NH3-SCR-NOx reaction conditions : insights from AIMD simulations

Reisel Millán CabreraPieter CnuddeVeronique Van SpeybroeckMercedes Boronat

A2 Journal Article in JACS AU

2020

A fundamental understanding of alkene adsorption and cracking in acid zeolite catalysts through advanced molecular simulations

Pieter CnuddeVeronique Van Speybroeck

Ab initio enhanced sampling kinetic study on MTO ethene methylation reaction

Simon BailleulKaren DedeckerPieter CnuddeLouis VanduyfhuysMichel WaroquierVeronique Van Speybroeck

A1 Journal Article in JOURNAL OF CATALYSIS

Cation-pi Interactions accelerate the living cationic ring-opening polymerization of unsaturated 2-alkyl-2-oxazolines

Elias Van Den BroeckBart VerbraekenKaren DedeckerPieter CnuddeLouis VanduyfhuysToon VerstraelenKristof Van HeckeValentin-Victor JercaSaron CatakRichard Hoogenboom et al.

A1 Journal Article in MACROMOLECULES

Light olefin diffusion during the MTO process on H-SAPO-34 : a complex interplay of molecular factors

Pieter CnuddeRuben DemuynckSteven VandenbrandeMichel WaroquierGerman SastreVeronique Van Speybroeck

A1 Journal Article in JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

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. NastasePieter CnuddeLouis VanduyfhuysKristof De WispelaereVeronique Van SpeybroeckC. Richard A. CatlowAndrew J. Logsdail

A1 Journal Article in ACS CATALYSIS

Theoretical and spectroscopic evidence of the dynamic nature of copper active sites in Cu-CHA catalysts under selective catalytic reduction (NH3–SCR–NOx) conditions

Reisel Millán CabreraPieter CnuddeAlexander HoffmanChristian W. LopesPatricia ConcepciónVeronique Van SpeybroeckMercedes Boronat

A1 Journal Article in JOURNAL OF PHYSICAL CHEMISTRY LETTERS

2019

Effect of zeolite topology and reactor configuration on the direct conversion of CO2 to light olefins and aromatics

Adrian RamirezAbhishek Dutta ChowdhuryAbhay DokaniaPieter CnuddeMustafa CaglayanIrina YarulinaEdy Abou-HamadLieven GeversSamy Ould-ChikhKristof De Wispelaere et al.

A1 Journal Article in ACS CATALYSIS

2018

How chain length and branching influence the alkene cracking reactivity on H-ZSM-5

Pieter CnuddeKristof De WispelaereLouis VanduyfhuysRuben DemuynckJeroen Van der MynsbruggeMichel WaroquierVeronique Van Speybroeck

A1 Journal Article in ACS CATALYSIS

2017

Effect of temperature and branching on the nature and stability of alkene cracking intermediates in H-ZSM-5

Pieter CnuddeKristof De WispelaereJeroen Van der MynsbruggeMichel WaroquierVeronique Van Speybroeck

A1 Journal Article in JOURNAL OF CATALYSIS

2016

On the stability and nature of adsorbed pentene in Bronsted acid zeolite H-ZSM-5 at 323 K

Julianna HajekJeroen Van der MynsbruggeKristof De WispelaerePieter CnuddeLouis VanduyfhuysMichel WaroquierVeronique Van Speybroeck

A1 Journal Article in JOURNAL OF CATALYSIS

2014

Energy-efficient light olefin recovery: absorption versus cryogenic distillation

Pieter ReyniersJoão Felipe dos SantosStephanie SaerensPieter CnuddeLaurien VandewalleThomas DeconinckSteven GovaertPhilip De SmedtKevin Van GeemGuy Marin

First-principle kinetic study of butene cracking on H-ZSM-5

Pieter CnuddeJeroen Van der MynsbruggeKristof De WispelaereKaren HemelsoetVeronique Van Speybroeck