Diffusion Time-Scale Invariance, Markovization Processes and Memory Effects in Lennard-Jones Liquids
arXiv:cond-mat/0401314 · doi:10.1103/PhysRevE.68.051201
Abstract
We report the results of calculation of diffusion coefficients for Lennard-Jones liquids, based on the idea of time-scale invariance of relaxation processes in liquids. The results were compared with the molecular dynamics data for Lennard-Jones system and a good agreement of our theory with these data over a wide range of densities and temperatures was obtained. By calculations of the non-Markovity parameter we have estimated numerically statistical memory effects of diffusion in detail.
10 pages, 3 figures