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PrOcess intensification and innovation in olefin ProducTIon by Multiscale Analysis and design

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Publications

Detailed experimental and kinetic modeling study of 3‐carene pyrolysis

Author(s): Jia Zhang, Florence Vermeire, Ruben Van de Vijver, Olivier Herbinet, Frédérique Battin‐Leclerc, Marie‐Françoise Reyniers, Kevin M. Van Geem
Published in: International Journal of Chemical Kinetics, 52/11, 2020, Page(s) 785-795, ISSN 0538-8066
Publisher: John Wiley & Sons Inc.
DOI: 10.1002/kin.21400

Combustion of ethylamine, dimethylamine and diethylamine: Theoretical and kinetic modeling study

Author(s): Cato A.R. Pappijn, Florence H. Vermeire, Ruben Van de Vijver, Marie-Françoise Reyniers, Guy B. Marin, Kevin M. Van Geem
Published in: Proceedings of the Combustion Institute, 38/1, 2021, Page(s) 585-592, ISSN 1540-7489
Publisher: Combustion Institute
DOI: 10.1016/j.proci.2020.07.045

Determination of heat capacity of carbon composites with application to carbon/phenolic ablators up to high temperatures

Author(s): Francisco Torres-Herrador, Alessandro Turchi, Kevin M. Van Geem, Julien Blondeau, Thierry E. Magin
Published in: Aerospace Science and Technology, 108, 2021, Page(s) 106375, ISSN 1270-9638
Publisher: Elsevier BV
DOI: 10.1016/j.ast.2020.106375

CFD-based assessment of steady-state multiplicity in a gas-solid vortex reactor for oxidative coupling of methane

Author(s): Laurien A. Vandewalle, Guy B. Marin, Kevin M. Van Geem
Published in: Chemical Engineering and Processing - Process Intensification, 165, 2021, Page(s) 108434, ISSN 0255-2701
Publisher: Elsevier BV
DOI: 10.1016/j.cep.2021.108434

Large eddy simulation of tubular reactors with spherical dimples

Author(s): Jens N. Dedeyne, David J. Van Cauwenberge, Pieter A. Reyniers, Kevin M. Van Geem, Guy B. Marin
Published in: Chemical Engineering Journal, 380, 2020, Page(s) 122463, ISSN 1385-8947
Publisher: Elsevier BV
DOI: 10.1016/j.cej.2019.122463

Carbon capture and utilization in the steel industry: challenges and opportunities for chemical engineering

Author(s): Kevin De Ras, Ruben Van de Vijver, Vladimir V Galvita, Guy B Marin, Kevin M Van Geem
Published in: Current Opinion in Chemical Engineering, 26, 2019, Page(s) 81-87, ISSN 2211-3398
Publisher: Elsevier BV
DOI: 10.1016/j.coche.2019.09.001

Boron-Modified Mesoporous ZSM-5 for the Conversion of Pyrolysis Vapors from LDPE and Mixed Polyolefins: Maximizing the C2–C4 Olefin Yield with Minimal Carbon Footprint

Author(s): Andreas Eschenbacher; Farnoosh Goodarzi; Robin John Varghese; Kasper Enemark-Rasmussen; Søren Kegnæs; Mehrdad Seifali Abbas-Abadi; Kevin Van Geem
Published in: ACS Sustainable Chem. Eng, 1, 2022, ISSN 2168-0485
Publisher: American Chemical Society
DOI: 10.1021/acssuschemeng.1c06098

Learning Molecular Representations for Thermochemistry Prediction of Cyclic Hydrocarbons and Oxygenates.

Author(s): Maarten R. Dobbelaere; Pieter Plehiers; Ruben Van de Vijver; Christian V. Stevens; Kevin Van Geem
Published in: Journal of Physical Chemistry A, 1, 2021, ISSN 1089-5639
Publisher: American Chemical Society
DOI: 10.1021/acs.jpca.1c01956

Bond additivity corrections for CBS‐QB3 calculated standard enthalpies of formation of H, C, O, N, and S containing species

Author(s): Cato A.R. Pappijn, Florence H. Vermeire, Ruben Van de Vijver, Marie‐Françoise Reyniers, Guy B. Marin, Kevin M. Van Geem
Published in: International Journal of Chemical Kinetics, 53/3, 2021, Page(s) 345-355, ISSN 0538-8066
Publisher: John Wiley & Sons Inc.
DOI: 10.1002/kin.21447

Catalytic Effect of Dimethyl Disulfide on Coke Formation on High-Temperature Alloys: Myth or Reality?

Author(s): Manjunath Patil, Stamatis A. Sarris, Kim Verbeken, Marie-Françoise Reyniers, Kevin M. Van Geem
Published in: Industrial & Engineering Chemistry Research, 59/34, 2020, Page(s) 15165-15178, ISSN 0888-5885
Publisher: American Chemical Society
DOI: 10.1021/acs.iecr.0c01693

Micromixing in a gas–liquid vortex reactor

Author(s): Yi Ouyang, Manuel Nunez Manzano, Koenraad Beirnaert, Geraldine J. Heynderickx, Kevin M. Van Geem
Published in: AIChE Journal, 2021, ISSN 0001-1541
Publisher: American Institute of Chemical Engineers
DOI: 10.1002/aic.17264

catchyFOAM: Euler–Euler CFD Simulations of Fluidized Bed Reactors with Microkinetic Modeling of Gas-Phase and Catalytic Surface Chemistry

Author(s): Laurien A. Vandewalle, Guy B. Marin, Kevin M. Van Geem
Published in: Energy & Fuels, 35/3, 2021, Page(s) 2545-2561, ISSN 0887-0624
Publisher: American Chemical Society
DOI: 10.1021/acs.energyfuels.0c02824

Alumina-based Coating for Coke Reduction in Steam Crackers

Author(s): Stamatis A. Sarris, Steffen H. Symoens, Natalia Olahova, Marie-Françoise Reyniers, Guy B. Marin, Kevin M. Van Geem
Published in: Materials, 13/9, 2020, Page(s) 2025, ISSN 1996-1944
Publisher: MDPI Open Access Publishing
DOI: 10.3390/ma13092025

Identification and quantification of lignin monomers and oligomers from reductive catalytic fractionation of pine wood with GC × GC – FID/MS

Author(s): Hang Dao Thi; Korneel Van Aelst; Sander Van den Bosch; Rui Katahira; Gregg T. Beckham; Bert F. Sels; Kevin M. Van Geem
Published in: Green chemistry, 1, 2022, ISSN 1463-9262
Publisher: Royal Society of Chemistry
DOI: 10.1039/d1gc03822b

Experimental and kinetic modeling study of the pyrolysis and oxidation of diethylamine

Author(s): Cato A.R. Pappijn, Nicolas Vin, Florence H. Vermeire, Ruben Van de Vijver, Olivier Herbinet, Frédérique Battin-Leclerc, Marie-Françoise Reyniers, Guy B. Marin, Kevin M. Van Geem
Published in: Fuel, 275, 2020, Page(s) 117744, ISSN 0016-2361
Publisher: Elsevier BV
DOI: 10.1016/j.fuel.2020.117744

Biomass fast pyrolysis in an innovative gas-solid vortex reactor: Experimental proof of concept

Author(s): Manuel Nunez Manzano, Arturo Gonzalez Quiroga, Patrice Perreault, Sepehr Madanikashani, Laurien A. Vandewalle, Guy B. Marin, Geraldine J. Heynderickx, Kevin M. Van Geem
Published in: Journal of Analytical and Applied Pyrolysis, 156, 2021, Page(s) 105165, ISSN 0165-2370
Publisher: Elsevier BV
DOI: 10.1016/j.jaap.2021.105165

Molecular Reconstruction of Hydrocarbons and Sulfur-Containing Compounds in Atmospheric and Vacuum Gas Oils

Author(s): Aleksandar Bojkovic; Thomas Dijkmans; Hang Dao Thi; Marko Djokic; Kevin Van Geem
Published in: Energy and Fuels, 1, 2022, ISSN 0887-0624
Publisher: American Chemical Society
DOI: 10.1021/acs.energyfuels.0c04025

Monometallic Cerium Layered Double Hydroxide Supported Pd-Ni Nanoparticles as High Performance Catalysts for Lignin Hydrogenolysis

Author(s): Tibo De Saegher, Jeroen Lauwaert, Jorku Hanssen, Els Bruneel, Matthias Van Zele, Kevin Van Geem, Klaartje De Buysser, An Verberckmoes
Published in: Materials, 13/3, 2020, Page(s) 691, ISSN 1996-1944
Publisher: MDPI Open Access Publishing
DOI: 10.3390/ma13030691

Dimples in turbulent pipe flows: experimental aero-thermal investigation

Author(s): M. Virgilio, J.N. Dedeyne, K.M. Van Geem, G.B. Marin, T. Arts
Published in: International Journal of Heat and Mass Transfer, 157, 2020, Page(s) 119925, ISSN 0017-9310
Publisher: Pergamon Press Ltd.
DOI: 10.1016/j.ijheatmasstransfer.2020.119925

Analytics Driving Kinetics: Advanced Mass Spectrometric Characterization of Petroleum Products

Author(s): Aleksandar Bojkovic; Florence H. Vermeire; Maja Kuzmanović; Hang Dao Thi; Kevin M. Van Geem
Published in: Energy & Fuels, 1, 2022, ISSN 0887-0624
Publisher: American Chemical Society
DOI: 10.1021/acs.energyfuels.1c02355

Computational fluid dynamics‐based optimization of dimpled steam cracking reactors for reduced CO 2 emissions

Author(s): Jens N. Dedeyne, Moreno Geerts, Pieter A. Reyniers, Florian Wéry, Kevin M. Van Geem, Guy B. Marin
Published in: AIChE Journal, 66/8, 2020, ISSN 0001-1541
Publisher: American Institute of Chemical Engineers
DOI: 10.1002/aic.16255

Study of the degradation of epoxy resins used in spacecraft components by thermogravimetry and fast pyrolysis

Author(s): Francisco Torres-Herrador; Francisco Torres-Herrador; Francisco Torres-Herrador; Andreas Eschenbacher; Julien Blondeau; Julien Blondeau; Thierry Magin; Kevin Van Geem
Published in: Journal of Analytical and applied pyrolysis, 1, 2021, ISSN 0165-2370
Publisher: Elsevier BV
DOI: 10.1016/j.jaap.2021.105397

Pyrometer-based control of a steam cracking furnace

Author(s): Stijn Vangaever, Pieter A. Reyniers, Steffen H. Symoens, Nenad D. Ristic, Marko R. Djokic, Guy B. Marin, Kevin M. Van Geem
Published in: Chemical Engineering Research and Design, 153, 2020, Page(s) 380-390, ISSN 0263-8762
Publisher: Institute of Chemical Engineers
DOI: 10.1016/j.cherd.2019.10.023

Distribution Changes during Thermal Degradation of Poly(styrene peroxide) by Pairing Tree-Based Kinetic Monte Carlo and Artificial Intelligence Tools

Author(s): Onur Dogu, Pieter P. Plehiers, Ruben Van de Vijver, Dagmar R. D’hooge, Paul H. M. Van Steenberge, Kevin M. Van Geem
Published in: Industrial & Engineering Chemistry Research, 60/8, 2021, Page(s) 3334-3353, ISSN 0888-5885
Publisher: American Chemical Society
DOI: 10.1021/acs.iecr.0c05414

The chemistry of chemical recycling of solid plastic waste via pyrolysis and gasification: State-of-the-art, challenges, and future directions

Author(s): Onur Dogu, Matteo Pelucchi, Ruben Van de Vijver, Paul H.M. Van Steenberge, Dagmar R. D'hooge, Alberto Cuoci, Marco Mehl, Alessio Frassoldati, Tiziano Faravelli, Kevin M. Van Geem
Published in: Progress in Energy and Combustion Science, 84, 2021, Page(s) 100901, ISSN 0360-1285
Publisher: Pergamon Press
DOI: 10.1016/j.pecs.2020.100901

Sustainable innovations in steam cracking: CO 2 neutral olefin production

Author(s): Ismaël Amghizar, Jens N. Dedeyne, David J. Brown, Guy B. Marin, Kevin M. Van Geem
Published in: Reaction Chemistry & Engineering, 5/2, 2020, Page(s) 239-257, ISSN 2058-9883
Publisher: Royal Society of Chemistry
DOI: 10.1039/c9re00398c

A Boudart Number for the Assessment of Irreducible Pellet-Scale Mass Transfer Limitations: Application to Oxidative Coupling of Methane

Author(s): Laurien A. Vandewalle, Kevin M. Van Geem, Guy B. Marin, René Bos
Published in: Industrial & Engineering Chemistry Research, 2021, ISSN 0888-5885
Publisher: American Chemical Society
DOI: 10.1021/acs.iecr.0c05517

Primary Thermal Decomposition Pathways of Hydroxycinnamaldehydes

Author(s): Liang Li; Ruben Van de Vijver; Andreas Eschenbacher; Onur Dogu; Kevin Van Geem
Published in: ENERGY & FUELS, 1, 2021, ISSN 0887-0624
Publisher: American Chemical Society
DOI: 10.1021/acs.energyfuels.1c01662

Detailed characterization of sulfur compounds in fast pyrolysis bio-oils using GC × GC-SCD and GC–MS

Author(s): Miloš Auersvald; Lukáš Kejla; Andreas Eschenbacher; Hang Dao Thi; Kevin Van Geem; Pavel Šimáček
Published in: Journal of Analytical and applied pyrolysis, 1, 2021, ISSN 0165-2370
Publisher: Elsevier BV
DOI: 10.1016/j.jaap.2021.105288

Pyrolysis of end-of-life polystyrene in a pilot-scale reactor: Maximizing styrene production

Author(s): Azd Zayoud; Hang Dao Thi; Marvin Kusenberg; Andreas Eschenbacher; Uros Kresovic; Nick Alderweireldt; Marko Djokic; Kevin M. Van Geem
Published in: Waste Management, 1, 2021, ISSN 0956-053X
Publisher: Pergamon Press Ltd.
DOI: 10.1016/j.wasman.2021.12.018