Three-Dimensional Molecular Dynamics Simulation on Heat Propagation in Liquid Argon
Guo Ying-Kui; Guo Zeng-Yuan; Liang Xin-Gang; Guo Ying-Kui; Department of Engineering Mechanics, Tsinghua University, Beijing 100084; Guo Zeng-Yuan; Department of Engineering Mechanics, Tsinghua University, Beijing 100084; Liang Xin-Gang; Department of Engineering Mechanics, Tsinghua University, Beijing 100084
Журнал:
Chinese Physics Letters
Дата:
2001-01-01
Аннотация:
The propagation behaviour of an initial thermal perturbation in liquid argon is simulated by the molecular dynamics method. The 12-6 Lennard-Jones potential and mirror boundary conditions are employed in the 32768-particle three-dimensional simulation. Macroscopic characteristics such as the kinetic temperature, pressure and momentum profiles are monitored during the simulation in order to examine the heat propagation behaviour under a timescale comparable with the relaxation time. The results show that the behaviour is still diffusion-like; no features predicted by the Cattaneo-Vernotte model have been found. The wave-like front of the local temperature may be caused by the adiabatic compression and expansion by the pressure wave generated by the thermal expansion. PACS: 44. 10. +i, 02. 70. Ns, 61. 25. Bi
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