Molecular dynamics simulation of supersaturated vapor nucleation in slit pore. II. Thermostatted atomic-wall model

K. T. Kholmurodov, Kenji Yasuoka, X. C. Zeng

Research output: Contribution to journalArticle

22 Citations (Scopus)

Abstract

Molecular dynamics simulations of supersaturated Lennard-Jones vapor nucleation in silt nanopores were performed. Results showed that the diffusion of absorbed particles on the structureless wall was faster than those on the atomic wall. It was also noticed that the rate of nucleus formation on the structureless wall was one order of magnitude lower. Sensitivity of the rate of nucleus formation on the wall was found more to the kinetics of adsorption of gas particles onto the wall than the diffusion rate of absorbed particles.

Original languageEnglish
Pages (from-to)9578-9584
Number of pages7
JournalJournal of Chemical Physics
Volume114
Issue number21
DOIs
Publication statusPublished - 2001 Jun 1

Fingerprint

slits
Molecular dynamics
Nucleation
Vapors
nucleation
vapors
molecular dynamics
porosity
Nanopores
Silt
Computer simulation
simulation
Gases
Adsorption
Kinetics
nuclei
adsorption
sensitivity
kinetics
gases

ASJC Scopus subject areas

  • Atomic and Molecular Physics, and Optics

Cite this

Molecular dynamics simulation of supersaturated vapor nucleation in slit pore. II. Thermostatted atomic-wall model. / Kholmurodov, K. T.; Yasuoka, Kenji; Zeng, X. C.

In: Journal of Chemical Physics, Vol. 114, No. 21, 01.06.2001, p. 9578-9584.

Research output: Contribution to journalArticle

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