Methanol-to-olefin conversion from first principles: unraveling the complex reaction network D. Lesthaeghe, V. Van Speybroeck, G.B. Marin, M. Waroquier TalkConference / event / venue Europacat VIIITurku/Abo, FinlandSunday, 26 August, 2007 to Friday, 31 August, 2007 Read more about Methanol-to-olefin conversion from first principles: unraveling the complex reaction network
Nanoslab formation from MFI precursors with interacting TPAOH P. Vansteenkiste, T. Verstraelen, V. Van Speybroeck, M. Waroquier TalkConference / event / venue Advanced micro- and mesoporous materialsVarna, BulgariaThursday, 6 September, 2007 to Sunday, 9 September, 2007 Read more about Nanoslab formation from MFI precursors with interacting TPAOH
New force-field models for biporous zeolites with guest molecules T. Verstraelen, P.W. Ayers, D. Van Neck, V. Van Speybroeck, M. Waroquier TalkConference / event / venue Advanced micro- and mesoporous materialsVarna, BulgariaThursday, 6 September, 2007 to Sunday, 9 September, 2007 Read more about New force-field models for biporous zeolites with guest molecules
Using Elementary Reactions to Model Growth Processes of Polyaromatic Hydrocarbons under Pyrolysis Conditions of Light Feedstocks K. Hemelsoet, V. Van Speybroeck, K.M. Van Geem, G.B. Marin, M. Waroquier TalkConference / event / venue AIChE's 2007 Annual MeetingSalt Lake City, Utah, USSunday, 4 November, 2007 to Friday, 9 November, 2007 Read more about Using Elementary Reactions to Model Growth Processes of Polyaromatic Hydrocarbons under Pyrolysis Conditions of Light Feedstocks
First Principle Simulations Of Reactions In Organic Solvents V. Van Speybroeck, M. D'Hooghe, N. De Kimpe, M. Waroquier TalkConference / event / venue AIChE's 2007 Annual MeetingSalt Lake City, Utah, USSunday, 4 November, 2007 to Friday, 9 November, 2007 Read more about First Principle Simulations Of Reactions In Organic Solvents
Ab initio reaction kinetics : Use of internal hindered rotors V. Van Speybroeck Invited talkConference / event / venue Combustion Chemistry Centre, National University of GalwayGalway, IrelandMonday, 11 February, 2008 to Tuesday, 12 February, 2008 Read more about Ab initio reaction kinetics : Use of internal hindered rotors
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 TalkConference / event / venue IXth Netherlands' Chemistry and Catalysis Conference (NCCC IX)Noordwijkerhout, The NetherlandsMonday, 3 March, 2008 to Wednesday, 5 March, 2008 Read more about Formation mechanisms for new zeolite materials from a molecular modeling perspective
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 TalkConference / event / venue IXth Netherlands' Chemistry and Catalysis Conference (NCCC IX)Noordwijkerhout, The NetherlandsMonday, 3 March, 2008 to Wednesday, 5 March, 2008 Read more about The Formation of Trans-Fused Macrocycles from N(3),N’(3)-Polymethylenebishydantoins Using Second-Generation Grubbs’ Catalyst
First principle chemical kinetics: From isolated molecules to supramolecular systems V. Van Speybroeck Invited talkConference / event / venue Eurokin’s 10th Anniversary meetingLyon, FranceMonday, 19 May, 2008 to Tuesday, 20 May, 2008 Read more about First principle chemical kinetics: From isolated molecules to supramolecular systems
On the structures and Reactivity of Cationic Rhodium Monodendate Phosphoramidites for hydrogenation of olefins V. Van Speybroeck Invited talkDSM, Geleen, The NetherlandsTuesday, 5 August, 2008 Read more about On the structures and Reactivity of Cationic Rhodium Monodendate Phosphoramidites for hydrogenation of olefins