Influence of dimethyl disulfide on coke formation during steam cracking of hydrocarbonsJIDONG WANG; REYNIERS, Marie-Francoise; MARIN, Guy B et al.Industrial & engineering chemistry research. 2007, Vol 46, Num 12, pp 4134-4148, issn 0888-5885, 15 p.Article

Microkinetic Modeling of Structural Properties of Poly(vinyl chloride)WIEME, Joris; REYNIERS, Marie-Françoise; MARIN, Guy B et al.Macromolecules (Print). 2009, Vol 42, Num 20, pp 7797-7810, issn 0024-9297, 14 p.Article

Reaction path analysis of propane selective oxidation over V₂O₅ and V₂O₅/TiO₂ALEXOPOULOS, Konstantinos; REYNIERS, Marie-Françoise; MARIN, Guy B et al.Journal of catalysis (Print). 2012, Vol 289, pp 127-139, issn 0021-9517, 13 p.Article

Reaction path analysis of propene selective oxidation over V₂O₅ and V₂O₅/TiO₂ALEXOPOULOS, Konstantinos; REYNIERS, Marie-Françoise; MARIN, Guy B et al.Journal of catalysis (Print). 2012, Vol 295, pp 195-206, issn 0021-9517, 12 p.Article

Liquid-phase alkylation of benzene with octenes over Y zeolites: Kinetic modeling including acidity descriptorsCRACIUN, Ionel; REYNIERS, Marie-Françoise; MARIN, Guy B et al.Journal of catalysis (Print). 2012, Vol 294, pp 136-150, issn 0021-9517, 15 p.Article

Physisorption and chemisorption of alkanes and alkenes in H-FAU : a combined ab initio-statistical thermodynamics studyDE MOOR, Bart A; REYNIERS, Marie-Francoise; MARIN, Guy B et al.PCCP. Physical chemistry chemical physics (Print). 2009, Vol 11, Num 16, pp 2939-2958, issn 1463-9076, 20 p.Article

Kinetics of heterogeneously MgO-catalyzed transesterificationDOSSIN, Tanguy F; REYNIERS, Marie-Francoise; MARIN, Guy B et al.Applied catalysis. B, Environmental. 2006, Vol 62, Num 1-2, pp 35-45, issn 0926-3373, 11 p.Article

Density functional study of the adsorption of 1,4-cyclohexadiene on Pt(111): origin of the C-H stretch red shiftSAEYS, Mark; REYNIERS, Marie-Francoise; MARIN, Guy B et al.Surface science. 2002, Vol 513, Num 2, pp 315-327, issn 0039-6028Article

Theoretical study of the adsorption of Cl-C4 primary alcohols in H-ZSM-5NGUYEN, Cuong M; REYNIERS, Marie-Françoise; MARIN, Guy B et al.PCCP. Physical chemistry chemical physics (Print). 2010, Vol 12, Num 32, pp 9481-9493, issn 1463-9076, 13 p.Article

Catalytic Cracking of Alkanes on FAU: Single-Event Microkinetic Modeling Including Acidity DescriptorsVAN BORM, Rhona; REYNIERS, Marie-Françoise; MARIN, Guy B et al.AIChE journal. 2012, Vol 58, Num 7, pp 2202-2215, issn 0001-1541, 14 p.Article

Ab initio study of free-radical polymerization : Polyethylene propagation kineticsVAN CAUTER, Karen; VAN SPEYBROECK, Veronique; VANSTEENKISTE, Peter et al.ChemPhysChem (Print). 2006, Vol 7, Num 1, pp 131-140, issn 1439-4235, 10 p.Article

Importance of Radical Transfer in Precipitation Polymerization : The Case of Vinyl Chloride Suspension PolymerizationWIEME, Joris; D'HOOGE, Dagmar R; REYNIERS, Marie-Francoise et al.Macromolecular reaction engineering (Print). 2009, Vol 3, Num 1, pp 16-35, issn 1862-832X, 20 p.Article

The kinetics of cyclization reactions on polyaromatics from first principlesVAN SPEYBROECK, Veronique; REYNIERS, Marie-Francoise; MARIN, Guy B et al.ChemPhysChem (Print). 2002, Vol 3, Num 10, pp 863-870, issn 1439-4235, 8 p.Article

First-principles based kinetic model for the hydrogenation of tolueneSAEYS, Mark; REYNIERS, Marie-Francoise; THYBAUT, Joris W et al.Journal of catalysis (Print). 2005, Vol 236, Num 1, pp 129-138, issn 0021-9517, 10 p.Article

Ab initio group contribution method for activation energies for radical additionsSAEYS, Mark; REYNIERS, Marie-Francoise; MARIN, Guy B et al.AIChE journal. 2004, Vol 50, Num 2, pp 426-444, issn 0001-1541, 19 p.Article

Kinetic Modeling of α-Hydrogen Abstractions from Unsaturated and Saturated Oxygenate Compounds by Carbon-Centered RadicalsPARASKEVAS, Paschalis D; SABBE, Maarten K; REYNIERS, Marie-Françoise et al.ChemPhysChem (Print). 2014, Vol 15, Num 9, pp 1849-1866, issn 1439-4235, 18 p.Article

Kinetics of α hydrogen abstractions from thiols, sulfides and thiocarbonyl compoundsVANDEPUTTE, Aaron G; SABBE, Maarten K; REYNIERS, Marie-Françoise et al.PCCP. Physical chemistry chemical physics (Print). 2012, Vol 14, Num 37, pp 12773-12793, issn 1463-9076, 21 p.Article

Molecular Reconstruction of Complex Hydrocarbon Mixtures: An Application of Principal Component AnalysisPYL, Steven P; VAN GEEM, Kevin M; REYNIERS, Marie-Françoise et al.AIChE journal. 2010, Vol 56, Num 12, pp 3174-3188, issn 0001-1541, 15 p.Article

Isobutene Protonation in H-FAU, H-MOR, H-ZSM-5, and H-ZSM-22NGUYEN, Cuong M; DE MOOR, Bart A; REYNIERS, Marie-Françoise et al.Journal of physical chemistry. C. 2012, Vol 116, Num 34, pp 18236-18249, issn 1932-7447, 14 p.Article

Kinetic Modeling as a Tool to Understand and Improve the Nitroxide Mediated Polymerization of Styrene^aBENTEIN, Lien; D'HOOGE, Dagmar R; REYNIERS, Marie-Françoise et al.Macromolecular theory and simulations. 2011, Vol 20, Num 4, pp 238-265, issn 1022-1344, 28 p.Article

Modeling the influence of resonance stabilization on the kinetics of hydrogen abstractionsSABBE, Maarten K; VANDEPUTTE, Aäron G; REYNIERS, Marie-Françoise et al.PCCP. Physical chemistry chemical physics (Print). 2010, Vol 12, Num 6, pp 1278-1298, issn 1463-9076, 21 p.Article

Kinetic Modeling of ICAR ATRPD'HOOGE, Dagmar R; KONKOLEWICZ, Dominik; REYNIERS, Marie-Françoise et al.Macromolecular theory and simulations. 2012, Vol 21, Num 1, pp 52-69, issn 1022-1344, 18 p.Article

Kinetic correlations for H₂ addition and elimination reaction mechanisms during silicon hydride pyrolysisADAMCZYK, Andrew J; REYNIERS, Marie-Françoise; MARIN, Guy B et al.PCCP. Physical chemistry chemical physics (Print). 2010, Vol 12, Num 39, pp 12676-12696, issn 1463-9076, 21 p.Article

Kinetics of Substituted Silylene Addition and Elimination in Silicon Nanocluster Growth Captured by Group AdditivityADAMCZYK, Andrew J; REYNIERS, Marie-Françoise; MARIN, Guy B et al.ChemPhysChem (Print). 2010, Vol 11, Num 9, pp 1978-1994, issn 1439-4235, 17 p.Article

Dimensional analysis for scaling up and down steam cracking coilsVAN GEEM, Kevin M; ZAJDLIK, Robert; REYNIERS, Marie-Francoise et al.Chemical engineering journal (1996). 2007, Vol 134, Num 1-3, pp 3-10, issn 1385-8947, 8 p.Conference Paper