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Review of Pt-based bimetallic catalysis: from model surfaces to supported catalysts
The field of heterogeneous catalysis, specifically catalysis on bimetallic alloys, has seen
many advances over the past few decades. Bimetallic catalysts, which often show electronic …
many advances over the past few decades. Bimetallic catalysts, which often show electronic …
The interaction of water with solid surfaces: fundamental aspects revisited
MA Henderson - Surface Science Reports, 2002 - Elsevier
Water is perhaps the most important and most pervasive chemical on our planet. The
influence of water permeates virtually all areas of biochemical, chemical and physical …
influence of water permeates virtually all areas of biochemical, chemical and physical …
Monolayer bimetallic surfaces: Experimental and theoretical studies of trends in electronic and chemical properties
The current review focuses on the general trends in the electronic and chemical properties
of monolayer bimetallic surfaces (MBS). The MBS is defined in this review as a monolayer of …
of monolayer bimetallic surfaces (MBS). The MBS is defined in this review as a monolayer of …
DFT studies for cleavage of C C and C O bonds in surface species derived from ethanol on Pt (111)
Results from self-consistent periodic DFT calculations were used to study the relative
stabilities and reactivities of surface species on Pt (111) derived by subsequent removal of …
stabilities and reactivities of surface species on Pt (111) derived by subsequent removal of …
A priori design of dual-atom alloy sites and experimental demonstration of ethanol dehydrogenation and dehydration on PtCrAg
Single-atom catalysts have received significant attention for their ability to enable highly
selective reactions. However, many reactions require more than one adjacent site to align …
selective reactions. However, many reactions require more than one adjacent site to align …
Organic chemistry on solid surfaces
Chemistry on solid surfaces is central to many areas of practical interest such as
heterogeneous catalysis, tribology, electrochemistry, and materials processing. With the …
heterogeneous catalysis, tribology, electrochemistry, and materials processing. With the …
[HTML][HTML] Density functional theory study of the electrochemical interface between a Pt electrode and an aqueous electrolyte using an implicit solvent method
We present a computational study of the interface of a Pt electrode and an aqueous
electrolyte employing semi-empirical dispersion corrections and an implicit solvent model …
electrolyte employing semi-empirical dispersion corrections and an implicit solvent model …
A Fast XPS study of the surface chemistry of ethanol over Pt {1 1 1}
The adsorption and reaction of ethanol over Pt {111} has been investigated by Fast XPS and
TPD. Ethanol adsorbs molecularly at 100 K, with a saturation coverage of 0.44 ML giving …
TPD. Ethanol adsorbs molecularly at 100 K, with a saturation coverage of 0.44 ML giving …
Adsorption and reactions of ethanol and ethanol–water mixture on alumina-supported Pt catalysts
M Dömök, M Tóth, J Raskó, A Erdőhelyi - Applied Catalysis B …, 2007 - Elsevier
The formation of surface species in the ethanol–water interaction and the reforming of
ethanol have been investigated on Pt/Al2O3 catalysts and for comparison on the support. By …
ethanol have been investigated on Pt/Al2O3 catalysts and for comparison on the support. By …
A first principles analysis of CO oxidation over Pt and Pt66. 7% Ru33. 3%(111) surfaces
Nonlocal gradient corrected DFT slab calculations were carried out to determine the overall
reaction energies along with the barriers for the activation of water and the oxidation of CO …
reaction energies along with the barriers for the activation of water and the oxidation of CO …