Ab Initio Simulations of Water/Metal Interfaces.
Sign Up to like & getrecommendations! Published in 2022 at "Chemical reviews"
DOI: 10.1021/acs.chemrev.1c00679
Abstract: Structures and processes at water/metal interfaces play an important technological role in electrochemical energy conversion and storage, photoconversion, sensors, and corrosion, just to name a few. However, they are also of fundamental significance as a… read more here.
Keywords: metal interfaces; water; water metal; water water ... See more keywords
Ten Facets, One Force Field: The GAL19 Force Field for Water - Noble Metal Interfaces.
Sign Up to like & getrecommendations! Published in 2020 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.0c00091
Abstract: Understanding the structure of the water/metal interfaces plays an important role in many areas ranging from surface chemistry to environmental processes. The size, required phase-space sampling and the slow diffusion of molecules at the water/metal… read more here.
Keywords: metal interfaces; water; force; force field ... See more keywords
Protection-failure mechanism of alkalinization and cathodic protection focusing on coating/metal interfaces
Sign Up to like & getrecommendations! Published in 2021 at "AIP Advances"
DOI: 10.1063/5.0037297
Abstract: Electrochemical impedance spectroscopy is a more rapid and convenient method for evaluating the anti-corrosion performance of the coatings, especially for the analysis of the evolution of water diffusion. However, due to the limitation of the… read more here.
Keywords: protection; protection failure; metal interfaces; focusing coating ... See more keywords