Diffusion of two particles with a finite interaction potential in one dimension.

J Chem Phys

Department of Chemistry, Massachusetts Institute of Technology, Cambridge, Massachusetts 02139, USA.

Published: October 2008

AI Article Synopsis

  • The study focuses on the behavior of two diffusing particles in a one-dimensional environment, considering their interactions via a steplike potential.
  • By solving the Fokker-Planck equation, the research derives an exact formula for the conditional probability density function, which helps determine how likely the particles are to have swapped positions or to remain close together over time.
  • The findings correlate well with simulations conducted using the Gillespie algorithm, reinforcing the validity of the theoretical results.

Article Abstract

We investigate the dynamics of two interacting diffusing particles in an infinite effectively one-dimensional system; the particles interact through a steplike potential of width b and height phi(0) and are allowed to pass one another. By solving the corresponding 2+1-variate Fokker-Planck equation, an exact result for the two-particle conditional probability density function (PDF) is obtained for arbitrary initial particle positions. From the two-particle PDF, we obtain the overtake probability, i.e., the probability that the two particles have exchanged positions at time t compared to the initial configuration. In addition, we calculate the trapping probability, i.e., the probability that the two particles are trapped close to each other (within the barrier width b) at time t, which is mainly of interest for an attractive potential, phi(0)<0. We also investigate the tagged particle PDF, relevant for describing the dynamics of one particle which is fluorescently labeled. Our analytic results are in excellent agreement with the results of stochastic simulations, which are performed using the Gillespie algorithm.

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Source
http://dx.doi.org/10.1063/1.2999602DOI Listing

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