K. De Wispelaere

On the Formation and Special Role of Formaldehyde in the Conversion of Methanol into Hydrocarbons

K. De Wispelaere, J. S. Martínez-Espín, S. Svelle, P. Beato, U. Olsbye, V. Van Speybroeck

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Talk

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25th North American Meeting of the Catalysis Society (NAM25)

Denver, CO, USA

Sunday, 4 June, 2017 to Friday, 9 June, 2017

Entropy sampling for zeolite-catalyzed reactions at operating conditions

K. De Wispelaere, T. Bligaard, J. K. Nørskov, V. Van Speybroeck

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Talk

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253rd American Chemical Society Meeting

San Francisco, CA, USA

Sunday, 2 April, 2017 to Friday, 7 April, 2017

On the nature and stability of butene cracking intermediates in H-ZSM-5

P. Cnudde, K. De Wispelaere, M. Waroquier, J. Van der Mynsbrugge, V. Van Speybroeck

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Poster

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FEARS2017

Ghent, Belgium

Wednesday, 15 February, 2017

Generation of active sites in UiO-66 with their application in catalysis

J. Hajek, K. De Wispelaere, M. Waroquier, V. Van Speybroeck

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Poster

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Chemical Research in Flanders Symposium (CRF-1)

Blankenberge, Belgium

Monday, 24 October, 2016 to Wednesday, 26 October, 2016

Research at the Center for Molecular Modeling

K. De Wispelaere

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Invited talk

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ExxonMobil European R&D Days 2016

Brussels, Belgium

Monday, 14 November, 2016 to Thursday, 17 November, 2016

Molecular simulations elucidate the nature and stability of alkene cracking intermediates on H-ZSM-5

P. Cnudde, K. De Wispelaere, J. Van der Mynsbrugge, M. Waroquier, V. Van Speybroeck

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Poster

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IAP Annual Meeting

Luik, Belgium

Monday, 12 September, 2016

A theoretical study of reactive intermediates in H-ZSM-5 catalyzed alkene cracking

P. Cnudde, K. De Wispelaere, J. Van der Mynsbrugge, J. Hajek, M. Waroquier, V. Van Speybroeck

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Talk

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Chemical Research in Flanders (CRF-1)

Blankenberge, Belgium

Monday, 24 October, 2016 to Wednesday, 26 October, 2016

Methylation of benzene by 2 methanol molecules in H-SSZ-24 at 350 °C

The active site for methanol conversion becomes mobile at realistic operating conditions

Generation of active sites for catalysis in UiO-66 studied by a complementary set of static and dynamic simulations

J. Hajek, K. De Wispelaere, A. De Vos, M. Waroquier, D. De Vos, V. Van Speybroeck

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Talk

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Annual IAP Meeting IAP-PAI P7/05

Liège, Belgium

Monday, 12 September, 2016

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