Hsiao Pai-Yi
Department of Engineering and System Science, National Tsing Hua University, Hsinchu 30013, Taiwan.
Institute of Nuclear Engineering and Science, National Tsing Hua University, Hsinchu 30013, Taiwan.
Polymers (Basel). 2018 Nov 6;10(11):1229. doi: 10.3390/polym10111229.
Langevin dynamics simulations are performed to study polyelectrolytes driven through a nanopore in monovalent and divalent salt solutions. The driving electric field is applied inside the pore, and the strength is varied to cover the four characteristic force regimes depicted by a rederived scaling theory, namely the unbiased (UB) regime, the weakly-driven (WD) regime, the strongly-driven trumpet (SD(T)) regime and the strongly-driven isoflux (SD(I)) regime. By changing the chain length , the mean translocation time is studied under the scaling form 〈 τ 〉 ∼ N α E - δ . The exponents α and δ are calculated in each force regime for the two studied salt cases. Both of them are found to vary with and and, hence, are not universal in the parameter's space. We further investigate the diffusion behavior of translocation. The subdiffusion exponent γ p is extracted. The three essential exponents ν s , , z p are then obtained from the simulations. Together with γ p , the validness of the scaling theory is verified. Through a comparison with experiments, the location of a usual experimental condition on the scaling plot is pinpointed.
进行朗之万动力学模拟,以研究在单价和二价盐溶液中通过纳米孔驱动的聚电解质。驱动电场施加在孔内,强度变化以涵盖由重新推导的标度理论描述的四种特征力 regime,即无偏(UB) regime、弱驱动(WD) regime、强驱动喇叭(SD(T)) regime和强驱动等通量(SD(I)) regime。通过改变链长,以标度形式〈τ〉∼NαE-δ研究平均转运时间。在两种研究盐的情况下,在每个力 regime中计算指数α和δ。发现它们都随[具体变量]和[具体变量]变化,因此在参数空间中不是通用的。我们进一步研究转运的扩散行为。提取次扩散指数γp。然后从模拟中获得三个基本指数νs、[具体变量]、zp。连同γp一起,验证了标度理论的有效性。通过与实验比较,在标度图上确定了通常实验条件的位置。