Analysis of Diffusion Limitation in the Alkylation of Benzene over H-ZSM-5 by Combining Quantum Chemical Calculations, Molecular Simulations, and a Continuum Approach
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چکیده
Quantum Chemical Calculations, Molecular Simulations, and a Continuum Approach N. Hansen,*,† R. Krishna,‡ J. M. van Baten,‡ A. T. Bell,*,§ and F. J. Keil† Department of Chemical Engineering, Hamburg UniVersity of Technology, D-21073 Hamburg, Germany, Van’t Hoff Institute for Molecular Sciences, UniVersity of Amsterdam, 1018 WV Amsterdam, The Netherlands, and Department of Chemical Engineering, UniVersity of California, Berkeley, CA; 94720-1462
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تاریخ انتشار 2009