Publications

Most recent A1 Publications

2021

Hydrogen Clathrates: Next Generation Hydrogen Storage Materials , A. Gupta, G.V. Baron, P. Perreault, S. Lenaerts, R.-G. Ciocarlan, P. Cool, P. M. Mileo, S.M.J. Rogge, V. Van Speybroeck, G. Watson, P. Van der Voort, M. Houlleberghs, E. Breynaert, J.A. Martens, J.F.M. Denayer , Energy Storage Materials , 41, 69-107 , 2021 , IF: 16.280 , 15/314 [Q1]
Reductive imino-pinacol coupling reaction of halogenated aromatic imines and iminium ions catalyzed by precious metal catalysts using hydrogen , K.N.R. Dumoleijn, E. Van den Broeck, J. Stavinoha, V. Van Speybroeck, K. Moonen, C.V. Stevens , Journal of Catalysis , 400, 103-113 , 2021 , IF: 7.888 , Q1
Towards modeling spatiotemporal processes in metal–organic frameworks , V. Van Speybroeck, S. Vandenhaute, A.E.J. Hoffman, S.M.J. Rogge , Trends in Chemistry , 3 (8): 605-619 , 2021 , IF: 24.081 , 8/179 [Q1]

Most recent talks

Invited talk
Towards modeling spatiotemporal processes within nanoporous materials , V. Van Speybroeck , Federation of European Zeolite Associations Conference (FEZA 2021) , virtual , Mon, 05/07/2021 to Fri, 09/07/2021
Invited talk
Operando modeling of zeolite catalyzed processes using first principle molecular dynamics approaches , V. Van Speybroeck , International Conference on Theoretical Aspects of Catalysis , Online Scientific Meeting , Mon, 14/06/2021 to Wed, 30/06/2021

Most recent conference posters

Quantifying the likelihood of structural models through a dynamically enhanced powder X-ray diffraction protocol , S. Borgmans, S.M.J. Rogge, V. Van Speybroeck , Faraday Discussions , Online , Tue, 13/10/2020 to Fri, 16/10/2020
Construction of a Ready-To-Use Database to Enable Accurate High-Throughput Screenings of Covalent Organic Frameworks , J. De Vos, S. Borgmans, S.M.J. Rogge, R. Demuynck, P. Van der Voort, V. Van Speybroeck , MolSim 2020 , Amsterdam, The Netherlands , Mon, 06/01/2020 to Fri, 17/01/2020
Ab initio modeling of the zeolite-catalyzed conversion of alkylphenols into phenol and olefins , M. Bocus, J. Hajek, Y. Liao, B. F. Sels, V. Van Speybroeck , MolSim 2020 , Amsterdam, The Nederlands , Mon, 06/01/2020 to Fri, 17/01/2020