Article ID Journal Published Year Pages File Type
5391784 Chemical Physics Letters 2007 6 Pages PDF
Abstract
The electric field dependence of vibrational frequency of H atoms on Pt electrodes was investigated by DFT calculations for the Pt13 cluster with adsorbed atop H atom. Calculations show that the external field, which was significantly enhanced by the solvent effect, affects Pt-H stretching frequency. Our results agree semi-quantitatively with large Pt-H frequency change observed experimentally.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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