Vibrational study of the hydrogen adsorption on the missing row platinum (110) surface
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The hydrogen vibration was investigated to analyze its affect on the hydrogen adsorption on the missing row platinum surface (H/Pt(110)-(1x2) model) in the ultrahigh vacuum (UHV). The density functional theory (DFT) combined with the approximation oscillation of the hydrogen atom on the surface was used. When the hydrogen coverage Θ H on the surface is 100% (Θ H = 1 ML), and taking into account the vibrational effect, the bond formed at the edge of the first layer (short bridge) is the most stable site. The vibrational effect on the adsorption model H/Pt(110)- (1x2) is significant.
Nội dung trích xuất từ tài liệu:
Vibrational study of the hydrogen adsorption on the missing row platinum (110) surface
Nội dung trích xuất từ tài liệu:
Vibrational study of the hydrogen adsorption on the missing row platinum (110) surface
Tìm kiếm theo từ khóa liên quan:
Hydrogen adsorption Missing row Pt(110)-(1x2) surface The density functional theory Density functional theory Taking into accountGợi ý tài liệu liên quan:
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