Department of Aerospace Engineering, Old Dominion University, Norfolk, Virginia 23529, USA.
J Phys Chem B. 2010 Mar 25;114(11):4082-93. doi: 10.1021/jp100784p.
The electrodiffusiophoretic motion of a charged spherical nanoparticle in a nanopore subjected to an axial electric field and electrolyte concentration gradient has been investigated using a continuum model, composed of the Poisson-Nernst-Planck equations for the ionic mass transport and the Navier-Stokes equations for the flow field. The charged particle experiences electrophoresis in response to the imposed electric field and diffusiophoresis caused solely by the imposed concentration gradient. The diffusiophoretic motion is induced by two different mechanisms, an electrophoresis driven by the generated electric field arising from the difference of ionic diffusivities and the double layer polarization and a chemiphoresis due to the induced osmotic pressure gradient around the charged nanoparticle. The electrodiffusiophoretic motion along the axis of a nanopore is investigated as a function of the ratio of the particle size to the thickness of the electrical double layer, the imposed concentration gradient, the ratio of the surface charge density of the nanopore to that of the particle, and the type of electrolyte. Depending on the magnitude and direction of the imposed concentration gradient, one can accelerate, decelerate, and even reverse the particle's electrophoretic motion in a nanopore by the superimposed diffusiophoresis. The induced electroosmotic flow in the vicinity of the charged nanopore wall driven by both the imposed and the generated electric fields also significantly affects the electrodiffusiophoretic motion.
采用连续介质模型研究了在轴向电场和电解质浓度梯度作用下带电荷的球形纳米粒子在纳米孔中的电渗扩散运动,该模型由用于离子质量传输的泊松-纳斯特-普朗克方程和用于流场的纳维斯托克斯方程组成。带电粒子会因所施加的电场而发生电泳,并且仅因所施加的浓度梯度而发生扩散泳动。扩散泳动是由两种不同的机制引起的,一种是由离子扩散率差异和双电层极化产生的电场引起的电泳,另一种是由于带电纳米粒子周围诱导的渗透压梯度引起的化学泳动。研究了纳米孔轴线上的电渗扩散运动作为粒子尺寸与双电层厚度比、所施加的浓度梯度、纳米孔表面电荷密度与粒子表面电荷密度比以及电解质类型的函数。根据所施加的浓度梯度的大小和方向,可以通过叠加扩散泳动来加速、减速甚至反转纳米孔中粒子的电泳运动。由所施加和产生的电场驱动的带电纳米孔壁附近的感应电渗流也会显著影响电渗扩散运动。