Zeolites and acid catalysis

Thursday, June 18, 2015: 8:00 AM-9:40 AM
408-410 (Lawrence Convention Center)
Líney Arnadóttir, Oregon State University, USA.
8:00 AM
Computational Examination of the Role of the Extended Framework in Alkane Conversion Kinetics in Zeolites
Shaama Mallikarjun Sharada1, Alexis T. Bell2 and Martin Head-Gordon2, (1)University of California Berkeley, USA, (2)University of California at Berkeley, USA.
8:20 AM
Ionic and Covalent Stabilization of Reactants and Transition States in Acid Catalysis: Methanol Dehydration on Polyoxometalate Clusters
Prashant Deshlahra and Enrique Iglesia, University of California Berkeley, USA.
8:40 AM
 Keynote 
Reactivity Descriptor in Solid Acid Catalysis: Predicting Turnover Frequencies for Propene Methylation in Zeotypes
Felix Studt, SLAC National Accelerator Laboratory, USA, Chuanming Wang, SINOPEC, China, Rasmus Brogaard, University of Oslo, Norway, Jens K. Nřrskov, Stanford University, USA and Bert M. Weckhuysen, Utrecht University, Netherlands.
9:20 AM
Development of Regioselective Hybrid Metal-Organic Framework/Metal Nanoparticle Catalysts: Insights from Molecular Simulation
Diego Gomez Gualdron, Cassandra Whitford and Randall Q. Snurr, Northwestern University, USA.
See more of: Catalyst Modelling and Simulation
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