Matches in SemOpenAlex for { <https://semopenalex.org/work/W2023180593> ?p ?o ?g. }
- W2023180593 endingPage "240" @default.
- W2023180593 startingPage "224" @default.
- W2023180593 abstract "Results from simulations of the adsorption of gases on transition metal surfaces are presented. Attention is devoted mainly to the adsorption of hydrogen on the (110) surfaces of W and Mo, the structures and adsorption kinetics of oxygen and CO on the Pt(111) surface, and the catalytic reaction of CO oxidation. The choice of these systems is motivated not only by their practical importance and fundamental interest but also by the fact that substantial progress has been made toward understanding the processes of adsorption and the formation of film structures for them with the use of the Monte Carlo method. One of the main requisites for simulation of the adsorbed film structures is to adequately incorporate the lateral interaction between adsorbed molecules, which includes both a direct interaction (electrostatic and exchange) and indirect (via electrons of the substrate). The correct description of the lateral interaction in the simulation has permitted explanation of the mechanisms of formation of the structures of CO films on platinum. At the same time, the complexity of the interaction between adsorbed atoms has at yet precluded the development of a consistent model for the formation of the structure of adsorbed oxygen on the platinum surface. It can be hoped that this problem will soon be solved, making it possible to refine the model of the catalytic reaction of CO oxidation." @default.
- W2023180593 created "2016-06-24" @default.
- W2023180593 creator A5011176594 @default.
- W2023180593 creator A5013767231 @default.
- W2023180593 creator A5033712636 @default.
- W2023180593 date "2005-03-01" @default.
- W2023180593 modified "2023-09-29" @default.
- W2023180593 title "Simulation of the adsorption of simple gases on transition metals (Review)" @default.
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