522534 Computational Screening of Metal-Organic Frameworks for Adsorption of Organophosphate Chemical Warfare Agents

Mayank Agrawal1, Jacob A. Harvey2, Dorina F. Sava Gallis2, Jeffery A. Greathouse2 and David S. Sholl3, (1)School of Chemical and Biomolecular Engineering, Georgia Institute of Technology, Atlanta, GA, (2)Geochemistry Department, Sandia National Laboratories, Albuquerque, NM, (3)School of Chemical & Biomolecular Engineering, Georgia Institute of Technology, Atlanta, GA