Theoretical elucidation of the reaction mechanism of methanol-to-olefin conversion in acidic zeolites D. Lesthaeghe, M. Waroquier, V. Van Speybroeck PosterConference / event / venue Frontiers of Chemistry (P042)Paris, FranceFriday, 21 May, 2010 Read more about Theoretical elucidation of the reaction mechanism of methanol-to-olefin conversion in acidic zeolites
The Car-Parrinello molecular dynamics method and its ability to discover new reaction pathways D. Lesthaeghe, V. Van Speybroeck, M. Waroquier TalkConference / event / venue Graduate Course on Theoretical Chemistry and SpectroscopyHan-sur-Lesse, BelgiumMonday, 8 December, 2003 to Friday, 12 December, 2003 Read more about The Car-Parrinello molecular dynamics method and its ability to discover new reaction pathways
Ab initio study on the chemical properties and possible applications of organic functionalized zeolites D. Lesthaeghe, V. Van Speybroeck, M. Waroquier TalkConference / event / venue 3rd EFCATS School of CatalysisUstron, PolandTuesday, 21 September, 2004 to Sunday, 26 September, 2004 Read more about Ab initio study on the chemical properties and possible applications of organic functionalized zeolites
Exploring the possibilities of organic-functionalized zeolites through ab initio calculations D. Lesthaeghe, V. Van Speybroeck, M. Waroquier TalkConference / event / venue WOG Contactforum: The active site - from catalyst to reactorBrussels (Belgium)Thursday, 19 May, 2005 to Friday, 20 May, 2005 Read more about Exploring the possibilities of organic-functionalized zeolites through ab initio calculations
Understanding the failure of direct mechanisms in the zeolite-catalysed MTO process through ab initio calculations D. Lesthaeghe, V. Van Speybroeck, G.B. Marin, M. Waroquier TalkConference / event / venue New trends in catalysisBrussels (Belgium)Tuesday, 11 October, 2005 to Thursday, 13 October, 2005 Read more about Understanding the failure of direct mechanisms in the zeolite-catalysed MTO process through ab initio calculations
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 TalkConference / event / venue 11th International Conference on Theoretical Aspects of CatalysisBerlin, GermanySunday, 11 June, 2006 to Wednesday, 14 June, 2006 Read more about Elementary reactions in the MTO process: Are we finally on the right track?
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 TalkConference / event / venue 232nd ACS national meeting: 'Symposium on Clean Fuels from Biomass'San Francisco, California, USASunday, 10 September, 2006 to Thursday, 14 September, 2006 Read more about Theoretical study on elementary reaction steps in the methanol-to-olefin process
The methanol-to-olefin process from theoretical perspective D. Lesthaeghe, B. De Sterck, V. Van Speybroeck, M. Waroquier TalkConference / event / venue VIIth Netherlands' Catalysis and Chemistry Conference (NCCC VII)Noordwijkerhout, The NetherlandsMonday, 5 March, 2007 to Wednesday, 7 March, 2007 Read more about The methanol-to-olefin process from theoretical perspective
Tackling the methanol-to-olefin problem through theoretical calculations: direct mechanisms vs. hydrocarbon pool model D. Lesthaeghe, B. De Sterck, V. Van Speybroeck, G.B. Marin, M. Waroquier TalkConference / event / venue 15th International Zeolite ConferenceBeijing, ChinaSunday, 12 August, 2007 to Friday, 17 August, 2007 Read more about Tackling the methanol-to-olefin problem through theoretical calculations: direct mechanisms vs. hydrocarbon pool model
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