Microstructure and its relaxation in FeB amorphous system simulated by moleculular dynamics

V. S. Stepanyuk, A. Szász, A. A. Katsnelson, O. S. Trushin, H. Müller, H. Kirchmayr

Research output: Contribution to journalArticle

29 Citations (Scopus)

Abstract

A computer simulation by molecular dynamics for the system Fe85B15 is presented, to explore the dynamics of structural transformation from liquid to amorphous state by a rapid quench. The truncated Morse potential is used to simulate the atomic interactions. Possible models of the actual amorphous structures are suggested based on the statistical analysis of Voronoi polyhedra. The obtained metastable state depend on the methods of sample preparation.

Original languageEnglish
Pages (from-to)80-87
Number of pages8
JournalJournal of Non-Crystalline Solids
Volume159
Issue number1-2
DOIs
Publication statusPublished - 1993

Fingerprint

atomic interactions
Morse potential
polyhedrons
metastable state
statistical analysis
computerized simulation
molecular dynamics
preparation
microstructure
Microstructure
liquids
Molecular dynamics
Statistical methods
Computer simulation
Liquids

ASJC Scopus subject areas

  • Ceramics and Composites
  • Electronic, Optical and Magnetic Materials

Cite this

Microstructure and its relaxation in FeB amorphous system simulated by moleculular dynamics. / Stepanyuk, V. S.; Szász, A.; Katsnelson, A. A.; Trushin, O. S.; Müller, H.; Kirchmayr, H.

In: Journal of Non-Crystalline Solids, Vol. 159, No. 1-2, 1993, p. 80-87.

Research output: Contribution to journalArticle

Stepanyuk, V. S. ; Szász, A. ; Katsnelson, A. A. ; Trushin, O. S. ; Müller, H. ; Kirchmayr, H. / Microstructure and its relaxation in FeB amorphous system simulated by moleculular dynamics. In: Journal of Non-Crystalline Solids. 1993 ; Vol. 159, No. 1-2. pp. 80-87.
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