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Computational study of diffusion of propane in small pore acidic zeotypes AFX and AEI

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Computational study of diffusion of propane in small pore acidic zeotypes AFX and AEI

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Sastre Navarro, GI. (2014). Computational study of diffusion of propane in small pore acidic zeotypes AFX and AEI. Catalysis Today. 226:25-36. doi:10.1016/j.cattod.2013.07.021

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Title: Computational study of diffusion of propane in small pore acidic zeotypes AFX and AEI
Author: Sastre Navarro, German Ignacio
UPV Unit: Universitat Politècnica de València. Instituto Universitario Mixto de Tecnología Química - Institut Universitari Mixt de Tecnologia Química
Issued date:
Abstract:
Small pore zeolites, containing 8-rings as the largest, are widely employed in commercial processes such as methanol-to-olefins or methanol-to-hydrocarbons. Diffusion in these materials has mainly been studied in pure ...[+]
Subjects: Small-pore acid zeolites , Propane diffusivity , Molecular dynamics , Methanol-to-hydrocarbons
Copyrigths: Cerrado
Source:
Catalysis Today. (issn: 0920-5861 )
DOI: 10.1016/j.cattod.2013.07.021
Publisher:
Elsevier
Publisher version: http://dx.doi.org/10.1016/j.cattod.2013.07.021
Project ID:
Ministerio de Economia y Competitividad of Spain SEV-2012-0267
Thanks:
This work has been made on the framework of a collaboration with professors Michel Waroquier and Veronique Van Speybroeck as well as assistant professor Karen Hemelsoet. Useful discussions and exchange of ideas is gratefully ...[+]
Type: Artículo

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