Pressure tensor and surface tension of an associating Lennard-Jones fluid confined in a closed spherical cavity
Chinese Journal of Physics（2019）
摘要
•Pressure profiles of an associating L-J fluid in a closed nanocavity are presented.•Difference of surface tensions of the fluid in closed and opened cavities are found.•Encapsulation energy of fluid in a cavity is calculated under various conditions.
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关键词
Associating Lennard-Jones fluid,Surface tension,Pressure tensor,Classical density functional theory
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