Adsorbate Diffusion on Transition Metal Nanoparticles
Abstract
Diffusion of adsorbates on transition metal nanoparticles is a precursor process for heterogeneously catalyzed reactions, and as a result, an atomistic understanding of the diffusion mechanism is very important. We systematically studied adsorption and diffusion of atomic and diatomic species (H, C, N, O, CO, and NO) on nanometer-sized Pt and Cu nanoparticles with different sizes and shapes using density functional theory calculations. We show...
Paper Details
Title
Adsorbate Diffusion on Transition Metal Nanoparticles
Published Date
Dec 5, 2014
Journal
Volume
15
Issue
1
Pages
629 - 634
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