524848 DFT Investigation of the Mechanism and Site Requirements for Alkane Dehydrogenation on Transition Metal Sulfide Catalysts

Ronak Upadhyay1, Lohit Sharma1, Jonas Baltrusaitas1 and Srinivas Rangarajan2, (1)Chemical and Biomolecular Engineering, Lehigh University, Bethlehem, PA, (2)Department of Chemical and Biomolecular Engineering, Lehigh University, Bethlehem, PA