Energy and structure of [11̄00] symmetric tilt grain boundaries in magnesium

Jyh Tyng Chou, Ken Ichi Ikeda, Hideharu Nakashima

Research output: Contribution to journalArticle

13 Citations (Scopus)

Abstract

For clarification of the grain boundary energy and the structure of magnesium [11̄00] symmetric tilt boundaries, the atomic structure was obtained by molecular dynamics simulations. The results are summarized as follows. The grain boundary energy of [11̄00] symmetric tilt boundary depends on misorientation angle. There is a large energy cusp at the angle which corresponds to (112̄2) Σ11 symmetric tilt boundary. The boundary is one of the twins. It was found that (112̄4) Σ10 and (112̄2) Σ11 boundaries consist of single structural units, while (112̄6) Σ35b, (224̄6) Σ59 and (224̄2) Σ35a boundaries consist of two different structural units, respectively.

Original languageEnglish
Pages (from-to)303-307
Number of pages5
JournalNippon Kinzoku Gakkaishi/Journal of the Japan Institute of Metals
Volume69
Issue number3
DOIs
Publication statusPublished - Mar 1 2005

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Magnesium
magnesium
Grain boundaries
grain boundaries
Molecular dynamics
energy
Computer simulation
cusps
atomic structure
misalignment
molecular dynamics
simulation

All Science Journal Classification (ASJC) codes

  • Condensed Matter Physics
  • Mechanics of Materials
  • Metals and Alloys
  • Materials Chemistry

Cite this

Energy and structure of [11̄00] symmetric tilt grain boundaries in magnesium. / Chou, Jyh Tyng; Ikeda, Ken Ichi; Nakashima, Hideharu.

In: Nippon Kinzoku Gakkaishi/Journal of the Japan Institute of Metals, Vol. 69, No. 3, 01.03.2005, p. 303-307.

Research output: Contribution to journalArticle

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