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The study of water wettability on solid surfaces by molecular dynamics simulation

Yu, Yinhao; Xu, Xiongwen*; Liu, Jinping; Liu, Yuehui; Cai, Wenhao; Chen, Jianxun
Science Citation Index Expanded
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摘要

The wetting of nanodroplets on solid surfaces was studied by molecular dynamics simulations. Through investigation of the contact angle of nanodroplets with different sizes, a relatively stable and accurate contact angle was obtained for a droplet radius of larger than 43 angstrom (1 angstrom =10(-10) m). The contact angles for droplets at different levels of solid-liquid forces were quantitatively evaluated. The results show that there is an excellent linear correlation between them in the angle range of 28 degrees to 167 degrees. Under a strong solid-liquid force, thin liquid film expansion in the three-phase line was found in nanometer-level simulations. The thin film spreading range increased with increasing solid-liquid force.

关键词

Water wettability Nanodroplets Molecular dynamics