Effect of aggregated gas molecules on dewetting transition of water between nanoscale hydrophobic plates

Using molecular dynamics simulations, we have investigated the hydrophobic interactions and influence of nitrogen molecules on the critical distance of dewetting between the nanoscale hydrophobic plates. We show that dewetting transition is very sensitive to the distribution of nitrogen molecules. T...

Ausführliche Beschreibung

Gespeichert in:
Bibliographische Detailangaben
Veröffentlicht in:The Journal of chemical physics 2019-03, Vol.150 (10), p.104702-104702
Hauptverfasser: Li, Weijian, Zuo, Xiaoliang, Zhou, Xiaoyan, Lu, Hangjun
Format: Artikel
Sprache:eng
Schlagworte:
Online-Zugang:Volltext
Tags: Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
Beschreibung
Zusammenfassung:Using molecular dynamics simulations, we have investigated the hydrophobic interactions and influence of nitrogen molecules on the critical distance of dewetting between the nanoscale hydrophobic plates. We show that dewetting transition is very sensitive to the distribution of nitrogen molecules. The nitrogen molecules prefer to aggregate in the vicinity of the two hydrophobic plates and exclude water molecules. Furthermore, our simulation results indicate that the effective range of hydrophobic attraction between the two nanoscale plates is enhanced by the aggregated nitrogen molecules. In particular, we find that the distribution patterns of nitrogen molecules are very different when the inter-plate region is filled with water or dewetted. These findings are helpful to understand the effects of gas molecules dissolved in water on hydrophobic interactions.
ISSN:0021-9606
1089-7690
DOI:10.1063/1.5082229