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Electrostatic correlations near charged planar surfaces

机译:带电平面附近的静电相关

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摘要

Electrostatic correlation effects near charged planar surfaces immersed in a symmetric electrolytes solution are systematically studied by numerically solving the nonlinear six-dimensional electrostatic self-consistent equations. We compare our numerical results with widely accepted mean-field (MF) theory results, and find that the MF theory remains quantitatively accurate only in weakly charged regimes, whereas in strongly charged regimes, the MF predictions deviate drastically due to the electrostatic correlation effects. We also observe a first-order like phase-transition corresponding to the counterion condensation phenomenon in strongly charged regimes, and compute the phase diagram numerically within a wide parameter range. Finally, we investigate the interactions between two likely-charged planar surfaces, which repulse each other as MF theory predicts in weakly charged regimes. However, our results show that they attract each other above a certain distance in strongly charged regimes due to significant electrostatic correlations.
机译:通过数值求解非线性六维静电自洽方程,系统地研究了浸在对称电解质溶液中的带电平面附近的静电相关效应。我们将数值结果与广泛接受的均场(MF)理论结果进行比较,发现MF理论仅在弱电荷状态下仍保持定量准确,而在强电荷状态下,MF预测由于静电相关效应而大不相同。我们还观察到与强电荷状态下的抗衡离子缩合现象相对应的一阶类似相变,并在较宽的参数范围内数值计算相图。最后,我们研究了两个可能带电的平面之间的相互作用,这在MF理论预测的弱带电状态下会相互排斥。然而,我们的结果表明,由于明显的静电相关性,它们在强电荷状态下彼此吸引超过一定距离。

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