James Weir Fluids Lab, Department of Mechanical and Aerospace Engineering, University of Strathclyde, Glasgow G1 1XJ, United Kingdom.
Department of Chemical Engineering, University of Bath, Bath BA2 7AY, United Kingdom.
J Chem Phys. 2014 Jan 7;140(1):014702. doi: 10.1063/1.4846300.
The high water flow rates observed in carbon nanotubes (CNTs) have previously been attributed to the unfavorable energetic interaction between the liquid and the graphitic walls of the CNTs. This paper reports molecular dynamics simulations of water flow in carbon, boron nitride, and silicon carbide nanotubes that show the effect of the solid-liquid interactions on the fluid flow. Alongside an analytical model, these results show that the flow enhancement depends on the tube's geometric characteristics and the solid-liquid interactions.
先前观察到的碳纳米管 (CNTs) 中的高水流速率归因于液体与 CNTs 的石墨壁之间不利的能量相互作用。本文报告了碳、氮化硼和碳化硅纳米管中水流的分子动力学模拟,这些模拟显示了固液相互作用对流体流动的影响。除了分析模型之外,这些结果表明,流动增强取决于管的几何特征和固液相互作用。