Phase equilibria of water in cylindrical nanopores

被引：58

作者：

Brovchenko, I

Geiger, A ^{[1
]}

Oleinikova, A

机构：

[1] Univ Dortmund, D-44221 Dortmund, Germany

[2] Ruhr Univ Bochum, D-44780 Bochum, Germany

来源：

PHYSICAL CHEMISTRY CHEMICAL PHYSICS | 2001年 / 3卷 / 09期

关键词：

D O I：

10.1039/b100922m

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

Phase equilibria of water in cylindrical nanopores were simulated in the Gibbs ensemble. The decrease of the critical temperature in the confinement compared to the bulk value attains 35% in the pores with radius R-c=12 Angstrom. The shape of the coexistence curve changes strongly with an increasing water-substrate interaction. This is found to be the result of a crossover from 3D surface to 2D behaviour in the surface layer. At the strongest water-substrate interactions of our study up to 3 coexistence curves are observed due to layering transitions.

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页码：1567 / 1569

页数：3

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