ON THE CALCULATION OF THE SELF-DIFFUSION COEFFICIENT OF INTERACTING BROWNIAN PARTICLES

ON THE CALCULATION OF THE SELF-DIFFUSION COEFFICIENT OF INTERACTING BROWNIAN PARTICLES
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DOI:
10.1063/1.446602
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发表时间:
1984-01-01
影响因子:
4.4
通讯作者:
DHONT, JKG
DHONT, JKG
中科院分区:
化学2区
文献类型:
--
作者:
LEKKERKERKER, HNW;DHONT, JKG

文献摘要

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考虑了两种计算相互作用布朗粒子自扩散系数的方法。第一种方法是基于从Smoluchowski方程开始的布朗粒子的均方位移的计算。在第二种方法中,自扩散系数作为热力学驱动力和迁移率的乘积获得。讨论了这两种方法的优点和局限性。
We consider two ways to calculate the self-diffusion coefficient of interacting Brownian particles. The first approach is based on the calculation of the mean square displacement of a Brownian particle starting from the Smoluchowski equation. In the second approach the self-diffusion coefficient is obtained as the product of the thermodynamic driving force and the mobility. The advantages and limitations of the two methods are discussed.