English

Decomposition of general grain boundaries

Materials Science 2025-09-11 v2 Computational Physics

Abstract

As a central part of microstructure evolution, grain boundary (GB) migration is believed to be both monolithic and unidirectional. But here, we introduce the concept of GB decomposition: one GB separates into two new GBs by exerting differential Peach-Koehler forces on its disconnections. Molecular dynamics simulation is used to reveal the disconnection mechanisms and direction-dependent motion behaviors associated with the reversible decomposition of a nickel {\Sigma}7 general GB. We also observed a decomposition-like process in a high-energy diffraction microscopy (HEDM) dataset of high purity nickel polycrystal (Science 2021, 374, 189-193), and performed HEDM-data-based simulations to confirm it. The decomposition should be considered as a new GB kinetic behavior, based on its particularity and potential universality.

Keywords

Cite

@article{arxiv.2507.00759,
  title  = {Decomposition of general grain boundaries},
  author = {Wei Wan and Junwen Deng and Changxin Tang},
  journal= {arXiv preprint arXiv:2507.00759},
  year   = {2025}
}

Comments

12 pages, 5 figures, 1 tables, 66 references

R2 v1 2026-07-01T03:41:36.110Z