538844 Modeling the Transformation of Ethene over MFI Using a Hybrid QM/MM Strategy

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: Poster Session: Computational Molecular Science and Engineering Forum (CoMSEF)
See more of this Group/Topical: Computational Molecular Science and Engineering Forum