School of Energy and Power Engineering, Northeast Electric Power University, Jilin 132012, China.
Phys Chem Chem Phys. 2018 May 3;20(17):11987-11993. doi: 10.1039/c8cp00956b.
Molecular dynamics simulations were applied to study the wetting properties of nanoscale droplets on a polar silica solid substrate subjected to constant and alternative electric fields with various field frequencies. Results show that the external applied electric fields have significant effects on the wetting of the nanoscale droplet on a polar solid substrate. The droplet spreads asymmetrically under the effect of the external applied field, and this asymmetry culminates to the maximum when the electric field equals to 0.45 V nm-1. For an electric field of 1.0 V nm-1, the dynamic electro-wetting process undergoes two stages even with a symmetric equilibrium spreading state. The stage A-B transition happens suddenly when molecules on the leading edge drop onto the solid surface due to the strong attraction of the solid substrate. Furthermore, under the alternative electric field with a different GHz frequency range, it was observed that the spreading asymmetry was weakened by increasing the field frequency and the nanoscale water droplet shape changes very slightly above a threshold frequency. 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. In addition, the polar solid surface has significant effects on the rearrangement of water molecules compared with a single droplet. Thus, the electro-wetting behaviors of water droplets on a silica solid surface are determined by the competing intermolecular forces among water, solid and the electric field.
运用分子动力学模拟研究了在恒定和交变电场作用下,具有不同场频率的纳米级液滴在极性二氧化硅固体基底上的润湿特性。结果表明,外电场对极性固体基底上纳米级液滴的润湿有显著影响。在外加电场的作用下,液滴呈不对称扩展,当电场等于 0.45 V nm-1 时,这种不对称性达到最大值。对于 1.0 V nm-1 的电场,即使在对称的平衡扩展状态下,动态电润湿过程也经历两个阶段。由于固体基底的强烈吸引力,前缘的分子突然落入固体表面,导致 A-B 阶段发生突然转变。此外,在具有不同 GHz 频率范围的交变电场下,随着场频率的增加,扩展不对称性减弱,并且在一个阈值频率以上,纳米级水滴的形状变化非常小。伴随着水滴形状的变化,由于电场诱导的水分子重新排列,水分子的分子偶极取向从随机无序分布到有序分布发生了显著变化。此外,与单个液滴相比,极性固体表面对水分子的重排有显著影响。因此,水滴在二氧化硅固体表面上的电润湿行为取决于水、固体和电场之间的竞争分子间力。