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Point defect absorption by grain boundaries in $\alpha$-iron by atomic density function modeling

Materials Science 2015-12-18 v1

Abstract

Using the atomic density function theory (ADFT), we examine the point defect absorption at [110] symmetrical tilt grain boundaries in body-centered cubic iron. It is found that the sink strength strongly depends on misorientation angle. We also show that the ADFT is able to reproduce reasonably well the elastic properties and the point defect formation volume in α\alpha-iron.

Keywords

Cite

@article{arxiv.1512.05492,
  title  = {Point defect absorption by grain boundaries in $\alpha$-iron by atomic density function modeling},
  author = {O. Kapikranian and H. Zapolsky and R. Patte and C. Pareige and B. Radiguet and P. Pareige},
  journal= {arXiv preprint arXiv:1512.05492},
  year   = {2015}
}

Comments

6 pages, 8 figures

R2 v1 2026-06-22T12:12:06.918Z