English

Derivation of the phase field crystal model for colloidal solidification

Soft Condensed Matter 2009-05-28 v2 Materials Science Statistical Mechanics

Abstract

The phase-field crystal model is by now widely used in order to predict crystal nucleation and growth. For colloidal solidification with completely overdamped individual particle motion, we show that the phase-field crystal dynamics can be derived from the microscopic Smoluchowski equation via dynamical density functional theory. The different underlying approximations are discussed. In particular, a variant of the phase-field crystal model is proposed which involves less approximations than the standard phase-field crystal model. We finally test the validity of these phase-field crystal models against dynamical density functional theory. In particular, the velocities of a linear crystal front from the undercooled melt are compared as a function of the undercooling for a two-dimensional colloidal suspension of parallel dipoles. Good agreement is only obtained by a drastic scaling of the free energies in the phase-field crystal model in order to match the bulk freezing transition point.

Keywords

Cite

@article{arxiv.0902.3363,
  title  = {Derivation of the phase field crystal model for colloidal solidification},
  author = {Sven van Teeffelen and Rainer Backofen and Axel Voigt and Hartmut Löwen},
  journal= {arXiv preprint arXiv:0902.3363},
  year   = {2009}
}

Comments

11 pages, 5 figures; corrected typos, minor changes after review

R2 v1 2026-06-21T12:13:23.761Z