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• W2025003655 abstract "The adsorption of Cl on metal surfaces is studied by a first-principles electronic-structure calculation withn the local-density-functional theory as a function of adatom coverage (ensuremath{Theta}). Hexagonal Cl layers with varying lattice constants are used as adlayers, and the substrate is modeled by the semi-infinite jellium. The work-function change, saturation ensuremath{Theta} for the adsorption, and the role of metal substrates for these electronic properties are studied through analyses of the calculated charge density, total energy, bond-order, and adatom density of states." @default.
• W2025003655 created "2016-06-24" @default.
• W2025003655 creator A5030941539 @default.
• W2025003655 date "1990-06-15" @default.
• W2025003655 modified "2023-10-18" @default.
• W2025003655 title "Coverage dependence of the electronic structure of chlorine adatoms on metal surfaces" @default.
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• W2025003655 doi "https://doi.org/10.1103/physrevb.41.12288" @default.
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