Paper Citing NAMD - Abstract
Jeong, Woog-Jin; Ha, Man Yeong; Yoon, Hyun Sik; Ambrosia, Matthew
Dynamic Behavior of Water Droplets on Solid Surfaces with Pillar-Type Nanostructures
LANGMUIR, 28:5360-5371, MAR 27 2012
In the present study, we investigated the static and dynamic behavior of water droplets on solid surfaces featuring pillar-type nano-structures by using molecular dynamics simulations. We carried out the computation in two stages. As a result of the first computational stage, an initial water cube reached an equilibrium state at which the water droplet showed different shapes depending on the height and the lateral and gap dimensions of the pillars. In the second computational stage, we applied a constant body force to the static water droplet obtained from the first computational stage and evaluated the dynamic behavior of the water droplet as it slid along the pillar-type surface. The dynamic behavior of the water droplet, which could be classified into three different groups, depended on the static state of the water droplet, the pillar characteristics (e.g., height and the lateral and gap dimensions of the pillars), and the magnitude of the applied body force. We obtained the advancing and receding contact angles and the corresponding contact angle hysteresis of the water droplets, which helped classify the water droplets into the three different groups.
