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Coarse-Grained Simulation of the Adsorption of Water on Au(111) Surfaces Using a Modified Stillinger–Weber Potential

[Image: see text] For reproducing the behavior of water molecules adsorbed on gold surfaces in terms of density of both bulk and interfacial water and in terms of structuring of water on top of gold atoms, the implementation of a multibody potential is necessary, thus the Stillinger–Weber potential...

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Detalles Bibliográficos
Autores principales: Ripani, Giorgio, Flachmüller, Alexander, Peter, Christine, Palleschi, Antonio
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2020
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7726742/
https://www.ncbi.nlm.nih.gov/pubmed/33324813
http://dx.doi.org/10.1021/acsomega.0c04071