Diffusion in Liquids: Results of Calculations by Molecular Dynamics Method

In the present paper the dependence of the self-diffusion coefficient in liquids on temperature and density is discussed. Our calculations using the molecular dynamics method show that the diffusion coefficient has a linear dependence on the temperature at the constant density of the liquid. Strong temperature dependence of the diffusion coefficient appears as a result of the strong dependence of the liquid density on the temperature. The acquired results are compared with the experimental data on the diffusion in liquid argon.

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Publication Details

Journal
Journal of Applied Mathematics and Physics
Published
2025-01-01
DOI
https://doi.org/10.4236/jamp.2025.136121
Primary Topic
nanoparticles nucleation surface interactions
Type
article
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article

Diffusion in Liquids: Results of Calculations by Molecular Dynamics Method

Georgii V. Kharlamov
1 links
Journal of Applied Mathematics and Physics
nanoparticles nucleation surface interactions
article

Diffusion in Liquids: Results of Calculations by Molecular Dynamics Method

Georgii V. Kharlamov
article en

Abstract

In the present paper the dependence of the self-diffusion coefficient in liquids on temperature and density is discussed. Our calculations using the molecular dynamics method show that the diffusion coefficient has a linear dependence on the temperature at the constant density of the liquid. Strong temperature dependence of the diffusion coefficient appears as a result of the strong dependence of the liquid density on the temperature. The acquired results are compared with the experimental data on the diffusion in liquid argon.

Journal of Applied Mathematics and PhysicsVol. 13(06)
Siberian Transport University (RU)
Openalex Percentile: Top 80%
nanoparticles nucleation surface interactions
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