Extended Brownian dynamics approach to diffusion-controlled processes

Gene Lamm, Klaus Schulten

Research output: Contribution to journalArticle

Abstract

The method of Brownian dynamics to simultate trajectories of particles diffusing under the influence of external forces is extended to the approximation of local linear forces and to reflective boundaries possibly confining the diffusion space. A simple algorithm for the generation of random diffusive displacements is developed and its validity demonstrated by comparison with analytical and numerical descriptions of sample one-dimensional diffusion distributions.

Original languageEnglish (US)
Pages (from-to)365-371
Number of pages7
JournalThe Journal of Chemical Physics
Volume75
Issue number1
DOIs
StatePublished - Jan 1 1981

ASJC Scopus subject areas

  • Physics and Astronomy(all)
  • Physical and Theoretical Chemistry

Fingerprint Dive into the research topics of 'Extended Brownian dynamics approach to diffusion-controlled processes'. Together they form a unique fingerprint.

  • Cite this