Phase-field model of precipitation processes with coherency loss

被引:31
|
作者
Cheng, Tian-Le [1 ,2 ]
Wen, You-Hai [1 ]
机构
[1] Natl Energy Technol Lab, Albany, OR 97321 USA
[2] Leidos Res Support Team, Albany, OR 97321 USA
基金
美国国家科学基金会;
关键词
Binary alloys - Integral equations - Coarsening - Particle size analysis - Ostwald ripening - Particle size - Computational efficiency;
D O I
10.1038/s41524-021-00503-x
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
A phase-field model is proposed to simulate coherency loss coupled with microstructure evolution. A special field variable is employed to describe the degree of coherency loss of each particle and its evolution is governed by a Ginzburg-Landau type kinetic equation. For the sake of computational efficiency, a flood-fill algorithm is introduced that can drastically reduce the required number of field variables, which allows the model to efficiently simulate a large number of particles sufficient for characterizing their statistical features during Ostwald ripening. The model can incorporate size dependence of coherency loss, metastability of coherent particles, and effectively incorporate the underlying mechanisms of coherency loss by introducing a so-called differential energy criterion. The model is applied to simulate coarsening of Al3Sc precipitates in aluminum alloy and comprehensively compared with experiments. Our results clearly show how the particle size distribution is changed during coherency loss and affects the coarsening rate.
引用
收藏
页数:11
相关论文
共 50 条
  • [1] Phase-field model of precipitation processes with coherency loss
    Tian-Le Cheng
    You-Hai Wen
    [J]. npj Computational Materials, 7
  • [2] Pattern formation in catalytic processes: Phase-field model
    Kuperman, MN
    Mikhailov, AS
    Wio, HS
    [J]. FOURTH GRANADA LECTURES IN COMPUTATIONAL PHYSICS, 1997, 493 : 309 - 309
  • [3] Upscaling of a tri-phase phase-field model for precipitation in porous media
    Redeker, Magnus
    Rohde, Christian
    Pop, Iuliu Sorin
    [J]. IMA JOURNAL OF APPLIED MATHEMATICS, 2016, 81 (05) : 898 - 939
  • [4] Dynamical phase-field model of coupled electronic and structural processes
    Tiannan Yang
    Long-Qing Chen
    [J]. npj Computational Materials, 8
  • [5] Dynamical phase-field model of coupled electronic and structural processes
    Yang, Tiannan
    Chen, Long-Qing
    [J]. NPJ COMPUTATIONAL MATERIALS, 2022, 8 (01)
  • [6] Precipitation kinetics of γ′ phase investigated by phase-field method
    Sun X.-S.-Y.
    Zhao Y.
    Lu X.-G.
    Sun X.-F.
    Zhou L.
    [J]. Zhongguo Youse Jinshu Xuebao/Chinese Journal of Nonferrous Metals, 2018, 28 (01): : 116 - 125
  • [7] Phase-field modeling of solute precipitation and dissolution
    Xu, Zhijie
    Meakin, Paul
    [J]. JOURNAL OF CHEMICAL PHYSICS, 2008, 129 (01):
  • [8] Phase-field modeling of the discontinuous precipitation reaction
    Amirouche, Lynda
    Plapp, Mathis
    [J]. ACTA MATERIALIA, 2009, 57 (01) : 237 - 247
  • [9] ON THE RELATION BETWEEN THE STANDARD PHASE-FIELD MODEL AND A THERMODYNAMICALLY CONSISTENT PHASE-FIELD MODEL
    PENROSE, O
    FIFE, PC
    [J]. PHYSICA D, 1993, 69 (1-2): : 107 - 113
  • [10] On a phase-field model with advection
    Benes, M
    [J]. NUMERICAL MATHEMATICS AND ADVANCED APPLICATIONS, PROCEEDINGS, 2004, : 141 - 150