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Hydrated Alkali Atoms on Copper(111): A Density Functional Theory Study

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We present a systematic computational study of submonolayer coverage of alkali atoms (Na, K, Cs) on Cu(111) surface hydrated from 1 to 6 water molecules. Our calculations show that water… Click to show full abstract

We present a systematic computational study of submonolayer coverage of alkali atoms (Na, K, Cs) on Cu(111) surface hydrated from 1 to 6 water molecules. Our calculations show that water molecules ...

Keywords: atoms copper; study; hydrated alkali; alkali atoms; copper 111

Journal Title: Journal of Physical Chemistry C
Year Published: 2021

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