Room-temperature ionic liquids (RTILs) have exciting properties such as nonvolatility, large
electrochemical windows, and remarkable variety, drawing much interest in energy storage …

The structure and friction of fatty acid surfactant films adsorbed on iron oxide surfaces
lubricated by squalane are examined using large-scale molecular dynamics simulations …

We use molecular dynamics to investigate how the structure, diffusion, and hydrodynamic
properties of clay interfaces with aqueous solutions depend on the nature of the clay, the …

The structure and frictional properties of glycerol monooleate (GMO) in organic solvents,
with and without water impurity, confined and sheared between two mica surfaces are …

This work focuses on a possible influence of a nanoporous medium on the thermodiffusion
of a fluid “isotopic” mixture. To do so, we performed molecular dynamics simulations of …

In this work, molecular dynamics simulations have been performed to shed some light on
possible gas leakages by molecular diffusion through reservoir caprocks. To do so, solubility …

In this article, the coupling between swelling and shear in liquid saturated slit nanopores is
studied using molecular dynamics simulations on Lennard-Jones systems. First, the …

The deformation of clay minerals is an important phenomenon that is relevant to many
problems, particularly those that occur in subsurface geological formations. The salinity of …

应用分子动力学方法研究纳米流道不同固–液间相互作用势能指数对液体流动特性的影响.
研究结果显示, 纳米尺度下流道出口高度及固液间相互作用势能不同会引起流体压力的改变 …

Various fluid flow phenomena originate in the dynamics of the atoms that constitute the fluid.
Studying fluids as a collection of atoms is key to a better understanding of, for example, non …