Abstract Surface-enhanced Raman Scattering (SERS) has become a powerful analytical
technique for highly sensitive detection of target molecules. Its performance, however, is …

Clathrate hydrates are solid crystalline structures most commonly formed from solutions that
have nucleated to form a mixed solid composed of water and gas. Understanding the …

Understanding the liquid-solid phase transition mechanisms and dynamics is of boundless
scientific significance, and holds enormous technological relevance in designing mono or …

The pollution caused by sulfuric acid mist emissions has attracted attention due to demand
of low emissions. In this work, molecular dynamics simulation was used to investigate effects …

Abstract The grand canonical Monte Carlo (GCMC) simulation method has been used to
estimate the disjoining pressure and to obtain the distribution of the density of the adsorbed …

Classical Nucleation Theory (CNT) has recently been used in conjunction with a seeding
approach to simulate nucleation phenomena at small-to-moderate supersaturation …

Water vapor nucleation on particle's surface plays an important role in dust removal, cloud
formation, and particle measurement. However, the selectivity of nucleation sites and the …

Ions make a significant contribution to the nucleation dynamics of aqueous aerosol particles,
but the understanding about microscopic mechanism is insufficient. In this paper, molecular …

The incipient process of water vapor condensation around an insoluble nanoscale particle is
studied by a molecular dynamics method, and the emphasis is placed on the effects of …

Recently, the embedded-seed-method molecular dynamics simulation is prevailing on
diverse issues of the solidification process of diverse materials. But the key universal issue …