npj Computational Materials (Sep 2021)

Phase field modeling for the morphological and microstructural evolution of metallic materials under environmental attack

  • Talha Qasim Ansari,
  • Haitao Huang,
  • San-Qiang Shi

DOI
https://doi.org/10.1038/s41524-021-00612-7
Journal volume & issue
Vol. 7, no. 1
pp. 1 – 21

Abstract

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Abstract The complex degradation of metallic materials in aggressive environments can result in morphological and microstructural changes. The phase-field (PF) method is an effective computational approach to understanding and predicting the morphology, phase change and/or transformation of materials. PF models are based on conserved and non-conserved field variables that represent each phase as a function of space and time coupled with time-dependent equations that describe the mechanisms. This report summarizes progress in the PF modeling of degradation of metallic materials in aqueous corrosion, hydrogen-assisted cracking, high-temperature metal oxidation in the gas phase and porous structure evolution with insights to future applications.