529098 Accurate Adsorbate Free Energies from First-Principles

Prateek Mehta, Anshumaan Bajpai, Kurt Frey, Andrew Lehmer, Gray Laughlin and William F. Schneider, Chemical and Biomolecular Engineering, University of Notre Dame, Notre Dame, IN
See more of this Session: Fundamentals of Catalysis IV: Surface Reactivity
See more of this Group/Topical: Catalysis and Reaction Engineering Division