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04. Boiling and Multi-Phase Flow

Molecular Dynamics Study on Influence of Quantum Nature on Liquid-Vapor Interfacial Properties

Liquid hydrogen has been recently focused as one of the useful storages or transportations of the clean energy source in industrial fields, and the detailed understanding of its liquid-vapor two-phase flow characteristics including boiling and cavitation phenomenon is becoming important because it is easily vaporized. However, in the microscopic point of view, the bubble inception or nucleation mechanisms have not been fully understood due to the related few experimental data. In this study, by using path integral centroid molecular dynamics method, we have evaluated the liquid-vapor interfacial thickness and the surface tension as the basic interfacial properties, and discussed the quantum influence of liquid hydrogen, which is known as an important factor for defining the liquid-vapor coexisting state. Resultingly, it was confirmed that the quantum influence of hydrogen enlarges the liquid-vapor interfacial thickness while that of hydrogen weakens the surface tension. In addition, we have found that the quantum influence can be appropriately scaled by using a characteristic length and intermolecular potential energy depth, both of which are the parameters of the effective intermolecular potential reflecting the quantum nature. Note that the present new insight above the liquid-vapor interfacial properties is useful for the modelling of the nucleation work, which is a dominant factor of the bubble nucleation rate in liquid hydrogen.

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Author Information

Mr.
Takanori Mori
Corresponding author, Presenting author
Prof.
Hiroki Nagashima
Prof.
Takashi Tokumasu
Prof.
Satoshi Watanabe
Prof.
Shin-ichi Tsuda