Park Jun Han, Shin Bo Sung, Jabbarzadeh Ahmad
Department of Cogno-Mechatronics Engineering, Pusan National University, Busan 609-735, Korea.
School of Aerospace, Mechanical and Mechatronic Engineering, The University of Sydney, Sydney, NSW 2006, Australia.
Langmuir. 2021 Dec 7;37(48):14186-14194. doi: 10.1021/acs.langmuir.1c02634. Epub 2021 Nov 22.
Large-scale molecular dynamic simulations were conducted to study anisotropic wettability on one-dimensional (1D) nanopatterned surfaces. Hexadecane (CH) and decane (CH) nanodroplets were used as wetting liquids. Initially, surfaces with various intrinsic wettability (oleophobic and oleophilic) were produced using surface lattice size as a control parameter. These surfaces were subsequently patterned with 1D grooves of different sizes, and their anisotropic wettability was examined. The results show that anisotropic wettability strongly depends on intrinsic surface wettability and surface morphology. The results also demonstrate that the anisotropy in the contact angle is negligible for oleophobic surfaces. However, the anisotropy becomes more evident for oleophilic surfaces and increases with the degree of oleophilicity. Results suggest that anisotropy also depends on the surface morphology, including the patterns' width and height. Monitoring the droplet shape showed that more significant droplet distortion was associated with higher anisotropy. A clear association was lacking between the roughness ratio, , and the degree of anisotropy. The observed average contact angle for 1D patterned oleophilic surfaces disagreed with the predicted values from the Wenzel theory. However, the theory could correctly predict the state of the droplet being Cassie-Baxter or Wenzel.
进行了大规模分子动力学模拟,以研究一维(1D)纳米图案化表面上的各向异性润湿性。使用十六烷(CH)和癸烷(CH)纳米液滴作为润湿液体。最初,以表面晶格尺寸作为控制参数,制备了具有各种固有润湿性(疏油和亲油)的表面。随后,这些表面用不同尺寸的一维凹槽进行图案化,并研究其各向异性润湿性。结果表明,各向异性润湿性强烈依赖于固有表面润湿性和表面形态。结果还表明,对于疏油表面,接触角的各向异性可以忽略不计。然而,对于亲油表面,各向异性变得更加明显,并随着亲油程度的增加而增加。结果表明,各向异性还取决于表面形态,包括图案的宽度和高度。监测液滴形状表明,更显著的液滴变形与更高的各向异性相关。粗糙度比与各向异性程度之间缺乏明显的关联。观察到的一维图案化亲油表面的平均接触角与温泽尔理论预测值不一致。然而,该理论可以正确预测液滴处于卡西 - 巴克斯特状态还是温泽尔状态。