The Proceedings of the Thermal Engineering Conference
Online ISSN : 2424-290X
2012
Session ID : B115
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B115 A Molecular Dynamics Study on the Influences of Nanostructure Geometry on the Liquid Molecular Behavior at a Liquid-Solid interface
Takahito KamiyaKunio FujiwaraMasahiko Shibanara
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Abstract
The nonequilibrium molecular dynamics simulations are conducted for the liquid wetting phenomena on a solid surface with a nanometer scale slit pore using SPC/E potential. The results show that the wetting phenomena of the slit pore depend on the liquid molecule-solid atoms interaction intensity and the width of the slit pore. There was a critical value of the liquid-solid interaction intensity which determines the wetting phenomena of the slit pore, and the critical value was changeable depending on the slit pore width. The calculation results didn't show pronounced differences qualitatively under the present simulation condition compared with the previous results obtained using Lennard-Jones(LJ) potential for liquid molecules.
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© 2012 The Japan Society of Mechanical Engineers
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