화학공학소재연구정보센터
Journal of Physical Chemistry B, Vol.109, No.9, 4152-4161, 2005
Behavior of evaporating droplets at nonsoluble and soluble surfaces: Modeling with molecular resolution
Liquid droplets in equilibrium with vapor are simulated at solidlike surfaces using the cooperative motion algorithm (CMA). These droplets behave like real droplets, i.e., the densities of the coexistent liquid and vapor phases obey empirical relations such as rho(l) - rho(v) proportional to (1 - T/T-c)(1/3). Droplet evaporation was studied under various interaction conditions, i.e., nonsoluble and Soluble Substrates. In the last case, substrate particles migrate toward the liquid-vapor interface to minimize the droplet surface energy. This leads to the formation of a microwell surrounded by a ringlike deposit on the substrate surface. It is shown that the ring formation in the first stages of evaporation results in pinning of the droplet contact area.