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- W2076702902 abstract "Cyclic voltammetry is a fundamental experimental method for characterizing electrochemical surfaces. Despite its wide use, a way to quantitatively and directly relate cyclic voltammetry to ab initio calculations has been lacking. We derive the cyclic voltammogram for H on Pt(111) and Pt(100), based solely on density functional theory calculations and standard molecular tables. By relating the gas phase adsorption energy to the electrochemical electrode potential, we provide a direct link between surface science and electrochemistry." @default.
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- W2076702902 date "2007-09-17" @default.
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- W2076702902 title "Cyclic Voltammograms for H on Pt(111) and Pt(100) from First Principles" @default.
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- W2076702902 doi "https://doi.org/10.1103/physrevlett.99.126101" @default.
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