V. Van Speybroeck

Ab initio reaction kinetics : Use of internal hindered rotors

V. Van Speybroeck

Invited talk

Conference / event / venue

Combustion Chemistry Centre, National University of Galway

Galway, Ireland

Monday, 11 February, 2008 to Tuesday, 12 February, 2008

Formation mechanisms for new zeolite materials from a molecular modeling perspective

V. Van Speybroeck, T. Verstraelen, P. Vansteenkiste, D. Lesthaeghe, A. Aerts, C. Kirschhock, J.A. Martens, M. Waroquier

Talk

Conference / event / venue

IXth Netherlands' Chemistry and Catalysis Conference (NCCC IX)

Noordwijkerhout, The Netherlands

Monday, 3 March, 2008 to Wednesday, 5 March, 2008

The Formation of Trans-Fused Macrocycles from N(3),N’(3)-Polymethylenebishydantoins Using Second-Generation Grubbs’ Catalyst

D.D. Claeys, N. Dieltiens, C.V. Stevens, V. Van Speybroeck, M. Waroquier

Talk

Conference / event / venue

IXth Netherlands' Chemistry and Catalysis Conference (NCCC IX)

Noordwijkerhout, The Netherlands

Monday, 3 March, 2008 to Wednesday, 5 March, 2008

First principle chemical kinetics: From isolated molecules to supramolecular systems

V. Van Speybroeck

Invited talk

Conference / event / venue

Eurokin’s 10th Anniversary meeting

Lyon, France

Monday, 19 May, 2008 to Tuesday, 20 May, 2008

On the structures and Reactivity of Cationic Rhodium Monodendate Phosphoramidites for hydrogenation of olefins

V. Van Speybroeck

Invited talk

DSM, Geleen, The Netherlands

Tuesday, 5 August, 2008

On the development of a partial vibrational analysis within a QM/MM approach

A. Ghysels, V. Van Speybroeck, B.R. Brooks, M. Waroquier

Talk

Conference / event / venue

3rd CMM 'Users Meet Developers' Workshop on QM/MM Simulations

Philadelphia, Pennsylvania, US

Thursday, 21 August, 2008 to Saturday, 23 August, 2008

Research activities CMM

V. Van Speybroeck

Invited talk

Jülich Forschungszentrum, Jülich, Germany

Friday, 29 August, 2008

First principle chemical kinetics : From gas phase to supramolecular systems

V. Van Speybroeck

Invited talk

Conference / event / venue

WATOC2008

Sydney, Australia

Sunday, 14 September, 2008 to Friday, 19 September, 2008

The methanol to olefin process from theoretical perspective

V. Van Speybroeck

Invited talk

Conference / event / venue

ESEP European Symposium 2008, Advanced Materials

Exxon Mobil, Belgium

Wednesday, 17 December, 2008

Deactivation of the catalyst during the MTO process from a molecular modeling perspective

K. Hemelsoet, D. Lesthaeghe, V. Van Speybroeck, M. Waroquier

Talk

Conference / event / venue

Xth Netherlands' Catalysis and Chemistry Conference (NCCC X)

Noordwijkerhout, The Netherlands

Monday, 2 March, 2009 to Thursday, 5 March, 2009

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