4.8 Article

Phase-field model of pitting corrosion kinetics in metallic materials

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NPJ COMPUTATIONAL MATERIALS
卷 4, 期 -, 页码 -

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NATURE PUBLISHING GROUP
DOI: 10.1038/s41524-018-0089-4

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  1. Research Grants Council of Hong Kong [PolyU 152140/14E]

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Pitting corrosion is one of the most destructive forms of corrosion that can lead to catastrophic failure of structures. This study presents a thermodynamically consistent phase field model for the quantitative prediction of the pitting corrosion kinetics in metallic materials. An order parameter is introduced to represent the local physical state of the metal within a metal-electrolyte system. The free energy of the system is described in terms of its metal ion concentration and the order parameter. Both the ion transport in the electrolyte and the electrochemical reactions at the electrolyte/metal interface are explicitly taken into consideration. The temporal evolution of ion concentration profile and the order parameter field is driven by the reduction in the total free energy of the system and is obtained by numerically solving the governing equations. A calibration study is performed to couple the kinetic interface parameter with the corrosion current density to obtain a direct relationship between overpotential and the kinetic interface parameter. The phase field model is validated against the experimental results, and several examples are presented for applications of the phase-field model to understand the corrosion behavior of closely located pits, stressed material, ceramic particles-reinforced steel, and their crystallographic orientation dependence.

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