The implementation and application of six-dimensional (6D) quantum dynamical methods to
the dissociative chemisorption of H2 on metal surfaces is reviewed. The validity of the …

Theoretical aspects of dynamical processes at metal surfaces are reviewed. Experimental
challenges to theory are presented and progress toward meeting these challenges is …

THE unique role that gold plays in society is to a large extent related to the fact that it is the
most noble of all metals: it is the least reactive metal towards atoms or molecules at the …

Based on density functional theory calculations of H2 dissociation on Al (111), Cu (111), Pt
(111) and Cu3Pt (111) we present a consistent picture of some key physical properties …

Low-energy heavy-ion fusion reactions are governed by quantum tunneling through the
Coulomb barrier formed by the strong cancellation of the repulsive Coulomb force with the …

An updated fourth edition of the text that provides an understanding of chemical
transformations and the formation of structures at surfaces The revised and enhanced fourth …

This book provides a detailed presentation of modern quantum theories for treating the
reaction dynamics of small molecular systems. Its main focus is on the recent development …

THE concentration of carbon dioxide in the atmosphere is increasing, largely because of
fossil-fuel combustion, but the rate of increase is only about half of the total emission rate1 …

We review recent progress in the understanding of the chemical dynamics of gas− surface
reactions. Such reactions can involve many dynamically distinct interactions. Our review …

We present ab initio density functional calculations within the generalized gradient
approximation for H 2 dissociating over Cu (111). The minimum barrier for dissociation is 0.5 …