THE STRUCTURE OF FLUIDS CONFINED TO SPHERICAL PORES - THEORY AND SIMULATION

被引：86
|
作者：
CALLEJA, M
NORTH, AN
POWLES, JG
RICKAYZEN, G
机构：
[1] Physics Laboratory, The University, Kent, Canterbury
来源：
MOLECULAR PHYSICS | 1991年 / 73卷 / 05期
关键词：
D O I：
10.1080/00268979100101701
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：
A study of the density profiles of a hard sphere and a Lennard-Jones fluid confined to spherical pores has been carried out using both computer simulation and a density functional proposed by Rickayzen and Augousti. For hard sphere fluids very good agreement between the results of theory and simulation are obtained. For the Lennard-Jones fluid, there is reasonable agreement between theory and simulation at the highest temperature studied (T = 2.01 T(c)) but the agreement deteriorates as the temperature of the fluid is reduced.
引用
收藏
页码：973 / 983
页数：11
相关论文
共 50 条
  • [31] Effects of a tiny sphere inserted in the center of a nano-spherical pore on the interfacial tension and surface adsorption of fluids confined in nanospherical pores
    Hemi, Abbas
    JOURNAL OF MOLECULAR LIQUIDS, 2016, 216 : 229 - 238
  • [32] STRUCTURE AND TRANSPORT IN INTERFACES AND CONFINED FLUIDS
    DAVIS, HT
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1987, 193 : 3 - PHYS
  • [33] Molecular simulation of nanoscopically confined fluids.
    Fichthorn, KA
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2001, 221 : U326 - U326
  • [34] A method for molecular dynamics simulation of confined fluids
    Wang, JC
    Fichthorn, KA
    JOURNAL OF CHEMICAL PHYSICS, 2000, 112 (19): : 8252 - 8259
  • [35] Structure of liquid and glassy methanol confined in cylindrical pores
    Morineau, D
    Guégan, R
    Xia, YD
    Alba-Simionesco, C
    JOURNAL OF CHEMICAL PHYSICS, 2004, 121 (03): : 1466 - 1473
  • [36] A theoretical study of the phase diagrams of simple fluids confined within narrow pores
    Votyakov, EV
    Tovbin, YK
    MacElroy, JMD
    Roche, A
    LANGMUIR, 1999, 15 (18) : 5713 - 5721
  • [37] On the theory of body motion in confined Stokesian fluids
    Procopio, Giuseppe
    Giona, Massimiliano
    JOURNAL OF FLUID MECHANICS, 2024, 1000
  • [38] Deep learning-based quasi-continuum theory for structure of confined fluids
    Wu, Haiyi
    Aluru, N. R.
    JOURNAL OF CHEMICAL PHYSICS, 2022, 157 (08):
  • [39] Local structure and density fluctuations in confined fluids
    Nygard, Kim
    CURRENT OPINION IN COLLOID & INTERFACE SCIENCE, 2016, 22 : 30 - 34
  • [40] Wall effects for spherical particle in confined shear-thickening fluids
    Tian, Shuai
    JOURNAL OF NON-NEWTONIAN FLUID MECHANICS, 2018, 257 : 13 - 21
12345