Adsorption of water molecules in slit pores

被引：45

作者：

Spohr, E

Trokhymchuk, A

Henderson, D

机构：

[1] Natl Autonomous Univ Mexico, Inst Quim, Mexico City 04510, DF, Mexico

[2] Brigham Young Univ, Dept Chem & Biochem, Provo, UT 84602 USA

[3] Univ Ulm, Abt Theoret Chem, D-89069 Ulm, Germany

[4] Natl Acad Sci Ukraine, Inst Condensed Matter Phys, Lviv 11, Ukraine

来源：

JOURNAL OF ELECTROANALYTICAL CHEMISTRY | 1998年 / 450卷 / 02期

基金：

美国国家科学基金会;

关键词：

molecular dynamics; slit pores; water structure; surface force; adsorption; capillary condensation;

D O I：

10.1016/S0022-0728(97)00645-1

中图分类号：

O65 [分析化学];

学科分类号：

070302 ; 081704 ;

摘要：

We report molecular dynamics (MD) simulations on the adsorption of water in attractive and repulsive slit pores, where the slit and a bulk region are in contact with each other. Water structure, surface force and adsorption behavior are investigated as a function of the overall density in the bulk region. The gas-liquid transition in both types of pores occurs at similar densities of the bulk region. (C) 1998 Elsevier Science S.A. All rights reserved.

引用

页码：281 / 287

页数：7

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