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Monomolecular Dehydration of Ethanol into Ethylene over H-MOR Studied by Density Functional Theory
[Image: see text] The framework effect of H-mordenite (H-MOR) zeolite on monomolecular dehydration of ethanol to ethylene has been simulated based on density functional theory. It is indicated that both the reaction mechanism and the activation energy barriers are significantly affected by the pore-...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2020
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7203697/ https://www.ncbi.nlm.nih.gov/pubmed/32391457 http://dx.doi.org/10.1021/acsomega.9b03984 |