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Wetting Behaviors of a Nano-Droplet on a Rough Solid Substrate under Perpendicular Electric Field

机译:垂直电场下纳米颗粒在粗糙固体基质上的润湿行为

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摘要

Molecular dynamic simulations were adopted to study the wetting properties of nanoscale droplets on rough silicon solid substrate subject to perpendicular electric fields. The effect of roughness factor and electric field strength on the static and dynamic wetting behaviors of a nano-droplet on a solid surface was investigated at the molecular level. Results show that the static contact angle tends to decrease slightly and show small difference with the increase of roughness factor, while it shows an obvious increase for the ramp-shaped surface because the appearing bottom space reduces the wettability of solid surface. Additionally, under the electric field, a nano-droplet was elongated in the field direction and the equilibrium contact angle increases with the increase of electric field strength. The nano-droplet was completely stretched to be column-shaped at a threshold value of the field. Besides, accompanied by the shape variation of water droplets, the molecular dipole orientations of water molecules experience a remarkable change from a random disordered distribution to an ordered profile because of the realignment of water molecules induced by electric fields.
机译:通过分子动力学模拟研究了纳米液滴在垂直电场作用下在粗糙的硅固体基底上的润湿性能。在分子水平上研究了粗糙度因子和电场强度对纳米液滴在固体表面上的静态和动态润湿行为的影响。结果表明,随着粗糙度系数的增加,静态接触角趋于略有减小,且变化不大,而由于表面底部空间的出现降低了固体表面的可湿性,因此对斜坡状表面的静接触角有明显的增加。另外,在电场作用下,纳米液滴在电场方向上被拉长,并且平衡接触角随着电场强度的增加而增加。纳米液滴在电场的阈值处完全拉伸成圆柱状。此外,伴随着水滴的形状变化,由于电场引起的水分子的重新排列,水分子的分子偶极子取向经历了从无序无序分布到有序分布的显着变化。

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