ArticleScientific reports2019
Structure, Dynamics, and Wettability of Water at Metal Interfaces.
Article in Scientific reports, 2019. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 13 papers.
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Who cites it
13 citing papers in PubMed.
- Unraveling the Wettability of Gold Surfaces: A Reactive Molecular Dynamics and Experimental Approach.The journal of physical chemistry. C, Nanomaterials and interfaces · 2026Article
- Role of Work Function and Potential of Zero Charge on Wetting of Metals.Chemphyschem : a European journal of chemical physics and physical chemistry · 2026Article
- Quantum sensing of microRNAs with nitrogen-vacancy centers in diamond.Communications chemistry · 2024Article
- Corrosion-driven droplet wetting on iron nanolayers.Scientific reports · 2023Article
- Anion-Induced Interfacial Liquid Layers on LiCoOJACS Au · 2023Article
- Fabrication and Experimental Study of Micro/Sub-Micro Porous Copper Coating for Anti-Icing Application.Materials (Basel, Switzerland) · 2023Article
- Thermodynamics of π-π Interactions of Benzene and Phenol in Water.International journal of molecular sciences · 2022Article
- Implicit Solvation Methods for Catalysis at Electrified Interfaces.Chemical reviews · 2022Review
- Wettability of Metal Surfaces Affected by Paint Layer Covering.Materials (Basel, Switzerland) · 2022Article
- On the importance of the electric double layer structure in aqueous electrocatalysis.Nature communications · 2022Article
- Microscopic origin of the effect of substrate metallicity on interfacial free energies.Proceedings of the National Academy of Sciences of the United States of America · 2021Article
- Degradation Behavior of Polymers Used as Coating Materials for Drug Delivery-A Basic Review.Polymers · 2021Review
- Tracking Charge Transfer to Residual Metal Clusters in Conjugated Polymers for Photocatalytic Hydrogen Evolution.Journal of the American Chemical Society · 2020Article
Corrections and comments
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Authors and funding
4 authors.
Funding
Abstract
The water/metal interface often governs important chemophysical processes in various technologies. Therefore, from scientific and engineering perspectives, the detailed molecular-level elucidation of the water/metal interface is of high priority, but the related research is limited. In experiments, the surface-science techniques, which can provide full structural details of the surface, are not easy to directly apply to the interfacial systems under ambient conditions, and the well-defined facets cannot be entirely free from contamination at the contact with water. To answer long-standing debates regarding the wettability, structure, and dynamics of water at metal interfaces, we here develop reliable first-principles-based multiscale simulations. Using the state-of-the-art simulations, we find that the clean metal surfaces are actually superhydrophilic and yield zero contact angles. Furthermore, we disclose an inadequacy of widespread ice-like bilayer model of the water adlayers on metal surfaces from both averaged structural and dynamic points of view. Our findings on the nature of water on metal surfaces provide new molecular level perspectives on the tuning and design of water/metal interfaces that are at the heart of many energy applications.
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Registered trials
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