533192 Examination of Brønsted and Lewis Acid-Catalyzed Alkane Reactions in MFI Zeolites Using a Hybrid QM/MM Scheme

Erum Mansoor, University of California-Berkeley, BERKELEY, CA, Martin Head-Gordon, Department of Chemistry, University of California at Berkeley, Berkeley, CA and Alexis T. Bell, Chemical and Biomolecular Engineering, University of California - Berkeley, Berkeley, CA
See more of this Session: Computational Catalysis V: Oxides, Zeolites, Porous Catalysts, and Supported Catalysts
See more of this Group/Topical: Catalysis and Reaction Engineering Division