Recent progress in the ab initio quantum chemistry study of cathode oxygen reduction on fuel cell catalysts is reviewed with emphasis on density functional theory and ab initio …
The purpose of this book is the development of the principles and experimental techniques underlying near edge X-ray absorption fine structure (NEXAFS) spectroscopy and the …
A model is presented which allows the determination of molecular orientations on surfaces from analysis of the angle-dependent resonance intensities in K-shell near-edge x-ray …
HP Bonzel - Surface Science Reports, 1988 - Elsevier
The study of coadsorption of alkali metals and simple molecules on transition metal surfaces has been a favored topic of research ever since the pioneering work by Langmuir in 1923 …
A Eichler, F Mittendorfer, J Hafner - Physical Review B, 2000 - APS
The dissociative adsorption of oxygen on the (111) surfaces of platinum, palladium, and nickel has been investigated using ab initio local-spin-density calculations. For all three …
K shell excitation spectra of the aromatic molecules benzene and pyridine in the gas phase are compared to those for the solids (ices) and for monolayers chemisorbed on Pt (111). The …
For O 2Pt (111) we have found four different adsorption phases which are formed at different substrate temperatures. At about 25 K the oxygen molecules physisorb on the surface. Two …
Ab initio local-spin-density calculations for the adsorption of O 2 on Pt (111) are presented. We identify two distinct, but energetically almost degenerate chemisorbed precursors. A …
Here we present a review of X-ray absorption spectroscopy and X-ray Raman scattering with the perspective to understand the spectra of water including changes with temperature …