Abstract
Two versions of the fundamental measure density functionals together with a new interfacial density profile parametrization were used to study the hard-sphere crystal-melt interface in the framework of the fundamental measure density functional theory. The equilibrium interfacial density profiles and interfacial free energies were found as a result of minimization of grand canonical potential of system with respect to parameters of density profile. We found that the average interfacial free energy is about , which is in reasonable agreement with simulation results.
- Received 16 December 2005
DOI:https://doi.org/10.1103/PhysRevE.73.031110
©2006 American Physical Society