论文标题

充电墙上的液体固定滑移:电荷分布的巨大影响

Liquid-solid slip on charged walls: dramatic impact of charge distribution

论文作者

Xie, Yanbo, Fu, Li, Niehaus, Thomas, Joly, Laurent

论文摘要

纳米流体系统对能量转化的应用表现出巨大的承诺,在纳米级液体固定滑道上可以增强其性能。但是,效率也由表面电荷控制,已知可以减少滑动。结合了分子动力学模拟和分析发展,我们显示了表面电荷分布对滑动芯耦合的巨大影响。同质带电的石墨烯具有非常有利的滑动关系(使用新的理论模型纠正现有弱点的新理论模型合理化),从而导致巨型电动能量转换。相比之下,由于被困在表面上的反状引起的粘性阻力,滑动在异质电荷的表面上受到强烈影响。在这种情况下,滑移应取决于控制结合离子比例的界面的详细物理化学。我们的数值结果和理论模型提供了有关液体固定滑移的分子机制的新基本见解,以及搜索具有最佳能量转换属性的新功能接口的实用准则,例如用于蓝色能量或废热收获。

Nanofluidic systems show great promises for applications in energy conversion, where their performance can be enhanced by nanoscale liquid-solid slip. However, efficiency is also controlled by surface charge, which is known to reduce slip. Combining molecular dynamics simulations and analytical developments, we show the dramatic impact of surface charge distribution on the slip-charge coupling. Homogeneously charged graphene exhibits a very favorable slip-charge relation (rationalized with a new theoretical model correcting some weaknesses of the existing ones), leading to giant electrokinetic energy conversion. In contrast, slip is strongly affected on heterogeneously charged surfaces, due to the viscous drag induced by counter-ions trapped on the surface. In that case slip should depend on the detailed physical chemistry of the interface controlling the fraction of bound ions. Our numerical results and theoretical models provide new fundamental insight on the molecular mechanisms of liquid-solid slip, and practical guidelines for searching new functional interfaces with optimal energy conversion properties, e.g. for blue energy or waste heat harvesting.

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