V. Van Speybroeck

Elementary reactions in the MTO process: Are we finally on the right track?

D. Lesthaeghe, B. De Sterck, V. Van Speybroeck, G.B. Marin, M. Waroquier

Talk

Conference / event / venue

11th International Conference on Theoretical Aspects of Catalysis

Berlin, Germany

Sunday, 11 June, 2006 to Wednesday, 14 June, 2006

On the activity of rhodium phosphoramidite asymmetric hydrogenation catalysts

V. Van Speybroeck, M. Waroquier, J.G. de Vries, R.J. Meier

Talk

Conference / event / venue

11th International Conference on Theoretical Aspects of Catalysis

Berlin, Germany

Sunday, 11 June, 2006 to Wednesday, 14 June, 2006

New developments in the parameterization of force fields based on ab initio training data

T. Verstraelen, D. Van Neck, P.W. Ayers, V. Van Speybroeck, M. Waroquier

http://www.cecam.org/workshop-4-55.html?presentation_id=1290

Talk

Conference / event / venue

CECAM Workshop: Computational aspects of building blocks, nucleation, and synthesis of porous materials

Lyon, France

Monday, 28 August, 2006 to Thursday, 31 August, 2006

On the activity of rhodium phosphoramidite asymmetric hydrogenation catalysts

V. Van Speybroeck, J.G. de Vries, R.J. Meier, M. Waroquier

http://oasys2.confex.com/acs/232nm/techprogram/P987427.HTM

Talk

Conference / event / venue

232nd ACS National Meeting, Division of Inorganic Chemistry, Section Organometallic: Catalysis

San Francisco, California, USA

Sunday, 10 September, 2006 to Thursday, 14 September, 2006

Theoretical study on elementary reaction steps in the methanol-to-olefin process

D. Lesthaeghe, B. De Sterck, V. Van Speybroeck, G.B. Marin, M. Waroquier

Talk

Conference / event / venue

232nd ACS national meeting: 'Symposium on Clean Fuels from Biomass'

San Francisco, California, USA

Sunday, 10 September, 2006 to Thursday, 14 September, 2006

On the activity of rhodium phosphoramidite asymmetric hydrogenation catalysts

V. Van Speybroeck

Invited talk

DSM, Geleen, The Netherlands

Tuesday, 17 October, 2006

Modeling Elementary Reactions in Coke Formation from First Principles

V. Van Speybroeck, K. Hemelsoet, D. Moran, G.B. Marin, M. Waroquier

Talk

Conference / event / venue

AIChE (American Institute of Chemical Engineering) , Industrial Applications of Computational Chemistry and Molecular Simulations

San Francisco (CA), US

Sunday, 12 November, 2006 to Friday, 17 November, 2006

Reactivity of Cationic Rhodium/MonoPhos Lewis-acid catalysts for hydrogenation of olefins

V. Van Speybroeck

Invited talk

Conference / event / venue

Workshop

Center for Surface Chemistry and Catalysis, Leuven

Thursday, 7 December, 2006 to Friday, 8 December, 2006

The methanol-to-olefin process from theoretical perspective

D. Lesthaeghe, B. De Sterck, V. Van Speybroeck, M. Waroquier

Talk

Conference / event / venue

VIIth Netherlands' Catalysis and Chemistry Conference (NCCC VII)

Noordwijkerhout, The Netherlands

Monday, 5 March, 2007 to Wednesday, 7 March, 2007

New methods in force-field development

T. Verstraelen, D. Van Neck, P.W. Ayers, V. Van Speybroeck, M. Waroquier

Talk

Conference / event / venue

VIIth Netherlands' Catalysis and Chemistry Conference (NCCC VII)

Noordwijkerhout, The Netherlands

Monday, 5 March, 2007 to Wednesday, 7 March, 2007

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