Sublimation phenomena in slit nanopores: Lennard-Jones phase diagram

被引：13

作者：

Kanda, H ^{[1
]}

Miyahara, M

Higashitani, K

机构：

[1] Cent Res Inst Elect Power Ind, Energy Engn Res Lab, Kanagawa 2400196, Japan

[2] Kyoto Univ, Dept Chem Engn, Kyoto 6158510, Japan

来源：

ADSORPTION-JOURNAL OF THE INTERNATIONAL ADSORPTION SOCIETY | 2005年 / 11卷 / Suppl 1期

关键词：

vapor-solid equilibria; nanopore; phase transition; Lennard-Jones; molecular simulation;

D O I：

10.1007/s10450-005-5940-5

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：

Sublimation phenomena of Lennard-Jones fluids in slit-shaped nanopores were examined. Vapor-phase pressure at which a solid phase forms in a pore at a constant temperature is determined by the authors' molecular dynamics technique. The obtained phase-boundary pressure is remarkably lower than that of the bulk phase. A simple model of the sublimation is presented, which successfully predicts the molecular dynamics results with no adjustable parameter. Thus, a whole Lennard-Jones phase diagram in slit-shaped nanopores can now be predicted.

引用

页码：295 / 299

页数：5

共 50 条

[21] A genetic algorithm for Lennard-Jones atomic clusters
Barrón, C
Gómez, S
Romero, D
Saavedra, A
APPLIED MATHEMATICS LETTERS, 1999, 12 (07) : 85 - 90
[22] Second virial coefficients of Lennard-Jones chains
Chiew, YC
Sabesan, V
FLUID PHASE EQUILIBRIA, 1999, 155 (01) : 75 - 83
[23] On the Hydrodynamic Stability of a Lennard-Jones Molecular Fluid
Raghavan, Bharath Venkatesh
Ostoja-Starzewski, Martin
JOURNAL OF STATISTICAL PHYSICS, 2019, 177 (01) : 61 - 77
[24] PHASE-EQUILIBRIA OF BINARY LENNARD-JONES MIXTURES WITH CUBIC EQUATIONS OF STATE
HARISMIADIS, VI
PANAGIOTOPOULOS, AZ
TASSIOS, DP
FLUID PHASE EQUILIBRIA, 1994, 94 : 1 - 18
[25] On the mean spherical approximation for the Lennard-Jones fluid
Tang, YP
Lu, BCY
FLUID PHASE EQUILIBRIA, 2001, 190 (1-2) : 149 - 158
[26] Analytical equation of state for Lennard-Jones mixtures
Tang, YP
Lu, BCY
FLUID PHASE EQUILIBRIA, 1998, 146 (1-2) : 73 - 92
[27] Temperature and composition dependence of the Soret coefficient in Lennard-Jones mixtures presenting consolute critical phenomena
Leonardi, Erminia
D'Aguanno, Bruno
Angeli, Celestino
JOURNAL OF CHEMICAL PHYSICS, 2010, 132 (12)
[28] Condensation of the Lennard-Jones fluid on the basis of the Gibbs single-phase approach
Ushcats, M. V.
JOURNAL OF CHEMICAL PHYSICS, 2013, 138 (09)
[29] Thermodynamic properties and structure of supercritical Stockmayer/Lennard-Jones fluid mixtures
Ohji, H
Morimoto, S
Fujihara, I
Murakami, S
FLUID PHASE EQUILIBRIA, 1997, 132 (1-2) : 47 - 60
[30] Freezing point depression in model Lennard-Jones solutions
Koschke, Konstantin
Limbach, Hans Joerg
Kremer, Kurt
Donadio, Davide
MOLECULAR PHYSICS, 2015, 113 (17-18) : 2725 - 2734

← 1 2 3 4 5 →