Simon Bailleul
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- Journal Article
- A1
- open access
Ab initio enhanced sampling kinetic study on MTO ethene methylation reaction
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Operando first principle simulations of important chemical transformations over zeolites within the methanol-to-olefin process
(2019) -
- Journal Article
- A1
- open access
Insight into the role of water on the methylation of hexamethylbenzene in H‐SAPO‐34 from first principle molecular dynamics simulations
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- Journal Article
- A1
- open access
A supramolecular view on the cooperative role of Brønsted and Lewis acid sites in zeolites for methanol conversion
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Structure–performance descriptors and the role of Lewis acidity in the methanol-to-propylene process