Go to the profile of Frank Abild-Pedersen

Frank Abild-Pedersen

Sr. Staff Scientist, SLAC National Accelerator Laboratory
Contributor

Classifying Activation Energies in Heterogeneous Catalysis

Computational efforts in heterogeneous catalysis are constantly striving towards a better and more accurate understanding of chemical reactions at interfaces. Simple energy relations based on bond order conservation principles are beginning to have a considerable impact on studies of catalytic reactivity and a new era of theory-driven catalyst design.
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Mar 08, 2018