Refinement of the supramolecular concept in methanol-to-olefin catalysis
- Author
- David Lesthaeghe (UGent) , Veronique Van Speybroeck (UGent) , Guy Marin (UGent) and Michel Waroquier (UGent)
- Organization
- Abstract
- The supramolecular character of methanol-to-olefin conversion in acidic zeolites is thoroughly investigated from a theoretical viewpoint. State-of-the-art modeling techniques have not only led to an absolute rejection of the intensively studied direct mechanisms, but have also provided additional insights into the alternative hydrocarbon pool proposal. The role of various external factors such as zeolite topology on the formation of crucial carbenium ions is discussed and the establaished supramolecular picture is refined.
- Keywords
- ALKYLATION, ETHYLENE, CONVERSION, ADSORPTION, ONIOM, HSAPO-34, MECHANISM, ZEOLITE, SHAPE-SELECTIVITY, HYDROCARBONS REACTION
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Citation
Please use this url to cite or link to this publication: http://hdl.handle.net/1854/LU-532198
- MLA
- Lesthaeghe, David, et al. “Refinement of the Supramolecular Concept in Methanol-to-Olefin Catalysis.” Studies in Surface Science and Catalysis, edited by Ruren Xu et al., vol. 170, Elsevier Science, 2007, pp. 1668–76, doi:10.1016/S0167-2991(07)81045-7.
- APA
- Lesthaeghe, D., Van Speybroeck, V., Marin, G., & Waroquier, M. (2007). Refinement of the supramolecular concept in methanol-to-olefin catalysis. In R. Xu, Z. Gao, J. Chen, & W. Yan (Eds.), Studies in Surface Science and Catalysis (Vol. 170, pp. 1668–1676). https://doi.org/10.1016/S0167-2991(07)81045-7
- Chicago author-date
- Lesthaeghe, David, Veronique Van Speybroeck, Guy Marin, and Michel Waroquier. 2007. “Refinement of the Supramolecular Concept in Methanol-to-Olefin Catalysis.” In Studies in Surface Science and Catalysis, edited by Ruren Xu, Zi Gao, Jiesheng Chen, and Wenfu Yan, 170:1668–76. Amsterdam, The Netherlands: Elsevier Science. https://doi.org/10.1016/S0167-2991(07)81045-7.
- Chicago author-date (all authors)
- Lesthaeghe, David, Veronique Van Speybroeck, Guy Marin, and Michel Waroquier. 2007. “Refinement of the Supramolecular Concept in Methanol-to-Olefin Catalysis.” In Studies in Surface Science and Catalysis, ed by. Ruren Xu, Zi Gao, Jiesheng Chen, and Wenfu Yan, 170:1668–1676. Amsterdam, The Netherlands: Elsevier Science. doi:10.1016/S0167-2991(07)81045-7.
- Vancouver
- 1.Lesthaeghe D, Van Speybroeck V, Marin G, Waroquier M. Refinement of the supramolecular concept in methanol-to-olefin catalysis. In: Xu R, Gao Z, Chen J, Yan W, editors. Studies in Surface Science and Catalysis. Amsterdam, The Netherlands: Elsevier Science; 2007. p. 1668–76.
- IEEE
- [1]D. Lesthaeghe, V. Van Speybroeck, G. Marin, and M. Waroquier, “Refinement of the supramolecular concept in methanol-to-olefin catalysis,” in Studies in Surface Science and Catalysis, Beijing, PR China, 2007, vol. 170, pp. 1668–1676.
@inproceedings{532198, abstract = {{The supramolecular character of methanol-to-olefin conversion in acidic zeolites is thoroughly investigated from a theoretical viewpoint. State-of-the-art modeling techniques have not only led to an absolute rejection of the intensively studied direct mechanisms, but have also provided additional insights into the alternative hydrocarbon pool proposal. The role of various external factors such as zeolite topology on the formation of crucial carbenium ions is discussed and the establaished supramolecular picture is refined.}}, author = {{Lesthaeghe, David and Van Speybroeck, Veronique and Marin, Guy and Waroquier, Michel}}, booktitle = {{Studies in Surface Science and Catalysis}}, editor = {{Xu, Ruren and Gao, Zi and Chen, Jiesheng and Yan, Wenfu}}, isbn = {{9780444530684}}, issn = {{0167-2991}}, keywords = {{ALKYLATION,ETHYLENE,CONVERSION,ADSORPTION,ONIOM,HSAPO-34,MECHANISM,ZEOLITE,SHAPE-SELECTIVITY,HYDROCARBONS REACTION}}, language = {{eng}}, location = {{Beijing, PR China}}, pages = {{1668--1676}}, publisher = {{Elsevier Science}}, title = {{Refinement of the supramolecular concept in methanol-to-olefin catalysis}}, url = {{http://doi.org/10.1016/S0167-2991(07)81045-7}}, volume = {{170}}, year = {{2007}}, }
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