AI Article Synopsis

  • Scientists used a special theory, called DDFT, to study how small hard disks (like balls) move and relax when packed closely together.
  • They looked at both theoretical results and real-life experiments and found they matched well when the disks weren't too tightly packed.
  • However, when the disks were packed really tight, the experiments showed different results from the theory, especially because the liquids around them had strong effects on how they moved.

Article Abstract

Using dynamical density functional theory (DDFT), we theoretically study Brownian self-diffusion and structural relaxation of hard disks and compare to experimental results on quasi two-dimensional colloidal hard spheres. To this end, we calculate the self-van Hove correlation function and distinct van Hove correlation function by extending a recently proposed DDFT-approach for three-dimensional systems to two dimensions. We find that the theoretical results for both self-part and distinct part of the van Hove function are in very good quantitative agreement with the experiments up to relatively high fluid packing fractions of roughly 0.60. However, at even higher densities, deviations between the experiment and the theoretical approach become clearly visible. Upon increasing packing fraction, in experiments, the short-time self-diffusive behavior is strongly affected by hydrodynamic effects and leads to a significant decrease in the respective mean-squared displacement. By contrast, and in accordance with previous simulation studies, the present DDFT, which neglects hydrodynamic effects, shows no dependence on the particle density for this quantity.

Download full-text PDF

Source
http://dx.doi.org/10.1063/1.5019447DOI Listing

Publication Analysis

Top Keywords

hard disks
8
dynamical density
8
density functional
8
functional theory
8
two-dimensional colloidal
8
colloidal hard
8
hard spheres
8
hove correlation
8
correlation function
8
distinct van
8

Similar Publications

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!