TY - JOUR
T1 - Local and instantaneous definition of liquid-vapor interface at the microscopic scale
AU - Kikugawa, Gota
AU - Takagi, Shu
AU - Matsumoto, Yoichiro
PY - 2007/1
Y1 - 2007/1
N2 - A novel definition of liquid-vapor interface at the molecular level is proposed, which can capture the local and instantaneous fluctuation of the interface. This definition is not based on the time- and space-averaged density profile, but on the instantaneous particle density distribution of molecules. Previously, the Gibbs dividing surface, which is the mathematical difinition decided from static density profile, is used to analyze the structure or interfacial physics. However, in this physical picture of the interface, the fluctuation itself and structure embedded in the fluctuation cannot be extracted. In this paper, we discuss the relation between the Gibbsian interface defined thermodynamically and the statistical-averaged interface of the local and instantaneous interface presented here. Furthermore, the interfacial fluctuation is evaluated by using the local and instantaneous interface, and an asymptotic character of the fluctuation is compared with the fluctuation predicted by the macroscopic capillary wave theory.
AB - A novel definition of liquid-vapor interface at the molecular level is proposed, which can capture the local and instantaneous fluctuation of the interface. This definition is not based on the time- and space-averaged density profile, but on the instantaneous particle density distribution of molecules. Previously, the Gibbs dividing surface, which is the mathematical difinition decided from static density profile, is used to analyze the structure or interfacial physics. However, in this physical picture of the interface, the fluctuation itself and structure embedded in the fluctuation cannot be extracted. In this paper, we discuss the relation between the Gibbsian interface defined thermodynamically and the statistical-averaged interface of the local and instantaneous interface presented here. Furthermore, the interfacial fluctuation is evaluated by using the local and instantaneous interface, and an asymptotic character of the fluctuation is compared with the fluctuation predicted by the macroscopic capillary wave theory.
KW - Gibbs dividing surface
KW - Interfacial fluctuation
KW - Level set method
KW - Liquid-vaper interface
KW - Molecular dynamics
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U2 - 10.1299/kikaib.73.118
DO - 10.1299/kikaib.73.118
M3 - Article
AN - SCOPUS:34248392284
SN - 0387-5016
VL - 73
SP - 118
EP - 125
JO - Nihon Kikai Gakkai Ronbunshu, B Hen/Transactions of the Japan Society of Mechanical Engineers, Part B
JF - Nihon Kikai Gakkai Ronbunshu, B Hen/Transactions of the Japan Society of Mechanical Engineers, Part B
IS - 1
ER -