In this work, we study the diffusion of nanodroplets on smooth surfaces through molecular dynamics (MD) simulations and theoretical analyses. Molecular dynamics simulations show that nanodroplet surface diffusion is different from that of single molecules and solid particles. The dependence of nanodroplet diffusion coefficient on temperature undergoes a transition from linear to nonlinear as th...

We have investigated, by means of density functional theory, the structure of a "scolium", that is, an electron circulating around a positively charged 4He nanodroplet, temporarily prevented from neutralization by the helium-electron repulsion. The positive ion core resides in the center of the nanodroplet where, as a consequence of electrostriction, a strong increase in the helium density with...

This work investigates the retraction and bouncing dynamics of an impacting low-viscosity nanodroplet on superhydrophobic surfaces via molecular simulations, aiming to reveal scaling laws velocities establish relationship between them. The velocity, Vre, is found scale as Vre ∼ Dmax/τc,n, where Dmax maximum spreading diameter, τc,n = (D0/V0)We1/2Oh1/3 inertial-capillary-viscous time, We Oh are ...

We perform molecular dynamics simulations to demonstrate that when a nanodroplet is confined inside a carbon nanotube (CNT), unidirectional motion can be created by a nonzero surface energy gradient. It is found that the water nanodroplet moves along the direction of increasing surface energy. The transportation efficiency of the water nanodroplet is found to be dependent on the surface energy ...

We study the thermophoretic motion of water nanodroplets confined inside carbon nanotubes using molecular dynamics simulations. We find that the nanodroplets move in the direction opposite the imposed thermal gradient with a terminal velocity that is linearly proportional to the gradient. The translational motion is associated with a solid body rotation of the water nanodroplet coinciding with ...

We show by molecular dynamics simulations that water nanodroplets can be transported along and around the surfaces of vibrated carbon nanotubes. In our simulations, a nanodroplet with a diameter of ∼4 nm is adsorbed on a (10,0) single-wall carbon nanotube, which is vibrated at one end with a frequency of 208 GHz and an amplitude of 1.2 nm. The generated linearly polarized transverse acoustic wa...