Publications

Recent A1 Articles Published online

Unexpected formation of 2,2-dichloro-N-(chloromethyl)acetamides during attempted Staudinger 2,2-dichloro-β-lactam synthesis , S. Deketelaere, E. Van den Broeck, L. Cools, D. Deturck, H. Naeyaert, K. Van Hecke, C. Stevens, V. Van Speybroeck, M. D'Hooghe , European Journal of Organic Chemistry , Published online , 2021 , IF: 3.021
Mobility and Reactivity of Cu+ Species in Cu-CHA Catalysts under NH3-SCR-NOx Reaction Conditions: Insights from AIMD Simulations , R. Millan, P. Cnudde, V. Van Speybroeck, M. Boronat , JACS Au (Journal of the American Chemical Society) , Published online , 2021

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]
Interfacial study of clathrates confined in reversed silica pores , P. M. Mileo, S.M.J. Rogge, M. Houlleberghs, E. Breynaert, J.A. Martens, V. Van Speybroeck , Journal of Materials Chemistry A , 9(38), 21835-21844 , 2021 , IF: 12.732 , 8/114 [Q1]
Large-Scale Molecular Dynamics Simulations Reveal New Insights Into the Phase Transition Mechanisms in MIL-53(Al) , S. Vandenhaute, S.M.J. Rogge, V. Van Speybroeck , Frontiers in Chemistry , 9: 699 , 2021 , IF: 5.221 , 53/178 [Q2]

Most recent talks

Invited talk
Operando modeling of realistic functional nanoporous materials , V. Van Speybroeck , IMX Seminar - Fall Series , Lausanne, Switzerland , Mon, 27/09/2021 to Mon, 13/12/2021
Talk
Unraveling surface interactions between clathrates and hydrophobic surfaces , P. M. Mileo, S.M.J. Rogge, V. Van Speybroeck , EUROMAT2021 , Online , Fri, 17/09/2021
Talk
Harder, better, faster, stronger: Designing hydrophobic cage-type materials as efficient high-rate shock absorbers , S.M.J. Rogge, Y. Sun, A. Lamaire, S. Vandenbrande, J. Wieme, C.R. Siviour, J.-C. Tan, V. Van Speybroeck , EuroMOF2021 , Online , Wed, 15/09/2021

Most recent conference posters

Mechanistic Insights on the Water-Zeolite Synergy in the Conversion of Biomass-Derived Guaiacol , M. Bocus, E. Van den Broeck, M. Bal, X. Wu, L. Vanduyfhuys, B. U. W. Maes, B. F. Sels, V. Van Speybroeck , Water in Zeolites Workshop , Liblice Castle, Czech Republic , Sun, 19/09/2021 to Wed, 22/09/2021
Quantifying the likelihood of structural models through a dynamically enhanced powder X-ray diffraction protocol , S. Borgmans, S.M.J. Rogge, J. De Vos, C.V. Stevens, P. Van der Voort, V. Van Speybroeck , EUROMOF2021 , Online , Mon, 13/09/2021 to Wed, 15/09/2021
Rationalizing the structural organisation of nanoconfined water by tuning the pore architecture of metal-organic frameworks , A. Lamaire, J. Wieme, S.M.J. Rogge, V. Van Speybroeck , EUROMOF2021 , Krakow (online) , Mon, 13/09/2021 to Wed, 15/09/2021