中文

Polymers Confined between Two Parallel Plane Walls

软凝聚态物质 2009-11-10 v2

摘要

Single three dimensional polymers confined to a slab, i.e. to the region between two parallel plane walls, are studied by Monte Carlo simulations. They are described by NN-step walks on a simple cubic lattice confined to the region 1zD1 \le z \le D. The simulations cover both regions D<<RFD << R_F and D>>RFD >> R_F (where RFNνR_F \sim N^\nu is the Flory radius, with ν0.587\nu \approx 0.587), as well as the cross-over region in between. Chain lengths are up to N=80,000N=80,000, slab widths up to D=120. In order to test the analysis program and to check for finite size corrections, we actually studied three different models: (a) Ordinary random walks (mimicking Θ\Theta-polymers); (b) Self-avoiding walks (SAW); and (c) Domb-Joyce walks with the self-repulsion tuned to the point where finite size corrections for free (unrestricted) chains are minimal. For the simulations we employ the pruned-enriched-Rosenbluth method (PERM) with Markovian anticipation. In addition to the partition sum (which gives us a direct estimate of the forces exerted onto the walls), we measure the density profiles of monomers and of end points transverse to the slab, and the radial extent of the chain parallel to the walls. All scaling laws and some of the universal amplitude ratios are compared to theoretical predictions.

关键词

引用

@article{arxiv.cond-mat/0309314,
  title  = {Polymers Confined between Two Parallel Plane Walls},
  author = {Hsiao-Ping Hsu and Peter Grassberger},
  journal= {arXiv preprint arXiv:cond-mat/0309314},
  year   = {2009}
}

备注

8 pages, 14 figures included