Application of scalar auxiliary variable scheme to phase-field equations

Rui Wang, Yanzhou Ji, Jie Shen, Long Qing Chen

Research output: Contribution to journalArticlepeer-review

1 Scopus citations

Abstract

It has been a continuing challenge to carry out simulations at time and spatial scales compatible with practical experimental observations. Here we implement a novel scalar auxiliary variable (SAV) scheme introduced in (Shen et al., 2018) for phase-field equations to drastically improve the numerical accuracy, efficiency and stability. We first bench-marked two representative phase-field method applications involving three-dimensional (3D) grain growth and spinodal phase separation. By implementing the SAV scheme within the state-of-the-art semi-implicit Fourier spectral scheme we achieved an order of magnitude improvement for the single-order-parameter Allen-Cahn equation and at least a 100% improvement for a set of multi-order-parameter Allen-Cahn equations for grain growth problems and the Cahn-Hilliard equation for compositional phase separation. More importantly, the efficiency enhancement of SAV becomes more dramatic as interfaces become sharper. Its application to the growth morphology and kinetics of β’-Mg7Nd precipitates demonstrates a remarkable improvement of more than 50 times in computational time. This work is expected to further stimulate the applications of phase-field simulations of a broad range of materials processes.

Original languageEnglish (US)
Article number111556
JournalComputational Materials Science
Volume212
DOIs
StatePublished - Sep 2022

All Science Journal Classification (ASJC) codes

  • General Computer Science
  • General Chemistry
  • General Materials Science
  • Mechanics of Materials
  • General Physics and Astronomy
  • Computational Mathematics

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