Density Functional Theory of Freezing and Phase Field Crystal Modeling

Simple item page
dc.creatorElder, K. R.
dc.creatorProvatas, Nikolas
dc.creatorBerry, Joel
dc.creatorStefanovic, Peter
dc.creatorGrant, Martin
dc.date2006-07-17
dc.date.accessioned2026-07-07T07:16:02Z
dc.date.available2026-07-07T07:16:02Z
dc.descriptionIn this paper the relationship between the density functional theory of freezing and phase field modeling is examined. More specifically a connection is made between the correlation functions that enter density functional theory and the free energy functionals used in phase field crystal modeling and standard models of binary alloys (i.e., regular solution model). To demonstrate the properties of the phase field crystal formalism a simple model of binary alloy crystallization is derived and shown to simultaneously model solidification, phase segregation, grain growth, elastic and plastic deformations in anisotropic systems with multiple crystal orientations on diffusive time scales.
dc.identifierhttps://arxiv.org/abs/cond-mat/0607419
dc.identifierhttp://arxiv.org/abs/cond-mat/0607419
dc.identifier.urihttp://salesiana.dossiersoluciones.com/handle/123456789/113441
dc.subjectMaterials Science
dc.titleDensity Functional Theory of Freezing and Phase Field Crystal Modeling
dc.typetext

Files

Collections

arXiv