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Monomolecular Cracking of Propane: Effect of Zeolite Confinement and Acidity

[Image: see text] The effect of zeolite pore geometry and intrinsic acidity on the activation energy of propane monomolecular cracking was investigated for six topologically distinct zeolites with different pore sizes. Periodic density functional theory calculations were used to calculate the activa...

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Detalles Bibliográficos
Autores principales: Alaithan, Zainab A., Mallia, Giuseppe, Harrison, Nicholas M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8908521/
https://www.ncbi.nlm.nih.gov/pubmed/35284742
http://dx.doi.org/10.1021/acsomega.1c05532