First-principles investigation of water adsorption on FeCrAl (110) surfaces

Wei, J; Li, S; Zhou, W; Shen, P; Ren, S; Hu, A; Zhou, WZ

Zhou, WZ (reprint author), City Univ Hong Kong, Dept Mech Engn, Hong Kong, Hong Kong, Peoples R China.

APPLIED SURFACE SCIENCE, 2019; 465 (): 259

Abstract

Using the first-principles calculations, the adsorption of the water on the FeCrAl surfaces is studied based on the density functional theory. The ato......

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