4.2 Article

Development of an atomic mobility database for disordered and ordered fcc phases in multicomponent Al alloys: focusing on binary systems

Journal

INTERNATIONAL JOURNAL OF MATERIALS RESEARCH
Volume 104, Issue 2, Pages 135-148

Publisher

WALTER DE GRUYTER GMBH
DOI: 10.3139/146.110846

Keywords

Diffusion; Atomic mobility; Al alloys; DICTRA; Order/disorder transition

Funding

  1. Creative Research Group of National Science Foundation of China [51021063]
  2. National Basic Research Program of China [2011CB610401]
  3. Key Program of the National Natural Science Foundation of China [50831007]
  4. Thermo-Calc Software AB under the Aluminum Alloy Database Project
  5. Alexander von Humboldt Foundation of Germany

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An atomic mobility database for binary disordered and ordered fcc phases in multicomponent Al-Cu-Fe-Mg-Mn-Ni-Si-Zn alloys was established based on a critical review of diffusion data in various constituent binary systems via the DICTRA (Diffusion Controlled TRAnsformation) software package. The mobility parameters for self-diffusion in the metastable fcc structure were determined through a semi-empirical method. An effective strategy, which takes the homogeneity range and defect concentration into account, was used to optimize the atomic mobilities of L1(2) phase in the Fe-Ni system. Comprehensive comparisons between various calculated and measured diffusivities show that most of the experimental data can be well reproduced by the presently obtained atomic mobilities. The general agreement between the model-predicted concentration profiles and the experimental ones in the Al-Ni-Si, Al-Mg-Zn and Cu-Mn-Ni-Zn diffusion couples validates the potential application of the present atomic mobility database to predict the concentration profiles in higher order systems. An 8-elemental diffusion couple was also simulated with the present database.

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