Catalytic Conversion of Alkenes on Acidic Zeolites: Automated Generation of Reaction Mechanisms and Lumping Technique

[Image: see text] Acid-catalyzed hydrocarbon transformations are essential for industrial processes, including oligomerization, cracking, alkylation, and aromatization. However, these chemistries are extremely complex, and computational (automatic) reaction network generation is required to capture...

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Detalles Bibliográficos
Autores principales: Koninckx, Elsa, Colin, Joseph G., Broadbelt, Linda J., Vernuccio, Sergio
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9242524/
https://www.ncbi.nlm.nih.gov/pubmed/35781936
http://dx.doi.org/10.1021/acsengineeringau.2c00004

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9242524/
https://www.ncbi.nlm.nih.gov/pubmed/35781936
http://dx.doi.org/10.1021/acsengineeringau.2c00004

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