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Surface reflectance anisotropy may be utilized for characterizing surfaces, interfaces, and adsorption structures. Here, the reflectance anisotropy and surface dielectric functions of the thermodynamically most favored water adsorbate structures on the Cu(110) surface (i.e. hexagonal bilayers, pentagonal chains, and partially dissociated water structures) are calculated from density-functional theory...
The adsorption of water monomers, small water clusters, water chains and water thin films on the Cu(110) surface is studied by density-functional theory (DFT) as well as using a semi-empirical scheme to include dispersion forces (DFT-D). Among the cluster structures, tetramers are most favorable. The calculated surface phase diagrams show that out of the multitude of Cu(110)-adsorbed water structures...
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