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Electric field controlled transport of water in graphene nano-channels

机译:石墨烯纳米通道中的电场控制运输

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摘要

Motivated by electrowetting-based flow control in nano-systems, water transport in graphene nano-channels is investigated as a function of the applied electric field. Molecular dynamics simulations are performed for deionized water confined in graphene nano-channels subjected to opposing surface charges, creating an electric field across the channel. Water molecules respond to the electric field by reorientation of their dipoles. Oxygen and hydrogen atoms in water face the anode and cathode, respectively, and hydrogen atoms get closer to the cathode compared to the oxygen atoms near the anode. These effects create asymmetric density distributions that increase with the applied electric field. Force-driven water flows under electric fields exhibit asymmetric velocity profiles and unequal slip lengths. Apparent viscosity of water increases and the slip length decreases with increased electric field, reducing the flow rate. Increasing the electric field above a threshold value freezes water at room temperature. Published by AIP Publishing.
机译:通过在纳米系统中的基于电润湿的流量控制的动机,作为施加的电场的函数研究了石墨烯纳米通道中的水运输。针对在经过相对的表面电荷的石墨烯纳米通道中,对去离子水进行分子动力学模拟,在通道上产生电场。水分分子通过重新定向偶极子来响应电场。与阳极附近的氧原子相比,水分地面对阳极和阴极的氧气和阴极,而氢原子越接近阴极。这些效果会产生与所施加的电场增加的不对称密度分布。电场下的力驱动的水流表现出不对称的速度型材和不平等的滑动长度。表观粘度随着电场的增加而增加,流量增加,减小了流速。增加阈值上方的电场在室温下冻结水。通过AIP发布发布。

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