Article ID Journal Published Year Pages File Type
5394296 Computational and Theoretical Chemistry 2013 9 Pages PDF
Abstract
► Favorable adsorption sites of CO and NO on Pd(1 1 1) at different coverages. ► Comparison between calculated and experimental vibrational frequencies. ► Physical origin of site preference of CO and NO at different coverages. ► Correlation between adsorption energy and surface coverage.
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Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
Origin of site preference of CO and NO adsorption on Pd(1 1 1) at different coverages: A density functional theory study
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