4 papers
Extraction of slip velocity in NEMD Couette flow systems using frictional dissipation
Hiroki Kusudo, Yasutaka Yamaguchi, Gota Kikugawa
Velocity slip at the solid--fluid (SF) interface plays a key role in fluid transport at the nanoscale, and the SF friction coefficient has been extensively studied because it indic…
Molecular anatomy of the pressure anisotropy in the interface of one and two component fluids: local thermodynamic description of the interfacial tension
Takeshi Omori, Yasutaka Yamaguchi
Through the decomposition of the pressure into the kinetic and the intermolecular contributions, we show that the pressure anisotropy in the fluid interface, which is the source of…
Mechanical and thermodynamic routes to the liquid-liquid interfacial tension and mixing free energy by molecular dynamics
Rei Ogawa, Hiroki Kusudo, Takeshi Omori +4
In this study, we carried out equilibrium molecular dynamics (EMD) simulations of the liquid-liquid interface between two different Lennard-Jones components with varying miscibilit…
Equilibrium and Non-Equilibrium Molecular Dynamics Simulation of Thermo-Osmosis: Enhanced Effects on Polarized Graphene Surfaces
Mehdi Ouadfel, Samy Merabia, Yasutaka Yamaguchi +1
Thermo-osmotic flows, generated by applying a thermal gradient along a liquid-solid interface, could be harnessed to convert waste heat into electricity. While this phenomenon has…