Abstract
The features of fcc metals atomic lattice structural reorganization under shift deformation are investigated. Mechanisms of deformation both for ideal crystalline and for a crystal containing various structural defects are analyzed. Investigations are carried out on the basis of computer simulations by mean of molecular dynamics method. It is shown that the beginning of structural reorganization of crystalline at plastic deformation is connected with atomic volume redistribution. In fcc lattice of metals it is possible to allocate local formations having hcp configuration and being some kind of precursor of irreversible structural changes in the atomic lattice. It was show also, that a nonuniform distribution of stress fields in the loaded crystal with structural defects may lead to the implementation of complex deformation mechanisms, including the formation of dynamic defects, which lifetimes are comparable with the Debye times. These theoretical studies can help to extend our knowledge about the materials with a crystalline structure behavior under dynamic loading.
| Original language | English |
|---|---|
| Pages (from-to) | 63-91 |
| Number of pages | 29 |
| Journal | International Journal of Terraspace Science and Engineering |
| Volume | 3 |
| Issue number | 1 |
| Publication status | Published - 1 Dec 2010 |
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Keywords
- Atomic volume
- Defect formation
- Dynamic defect
- Plastic deformation
- Proto-defect
ASJC Scopus subject areas
- Engineering(all)
Cite this
Structural rearrangement in fcc metals under shear deformation. Molecular dynamics simulation. / Psakhie, S. G.; Zolnikov, K. P.; Dmitriev, A. I.; Kryzhevich, D. S.; Nikonov, A. Y.
In: International Journal of Terraspace Science and Engineering, Vol. 3, No. 1, 01.12.2010, p. 63-91.Research output: Contribution to journal › Article
}
TY - JOUR
T1 - Structural rearrangement in fcc metals under shear deformation. Molecular dynamics simulation
AU - Psakhie, S. G.
AU - Zolnikov, K. P.
AU - Dmitriev, A. I.
AU - Kryzhevich, D. S.
AU - Nikonov, A. Y.
PY - 2010/12/1
Y1 - 2010/12/1
N2 - The features of fcc metals atomic lattice structural reorganization under shift deformation are investigated. Mechanisms of deformation both for ideal crystalline and for a crystal containing various structural defects are analyzed. Investigations are carried out on the basis of computer simulations by mean of molecular dynamics method. It is shown that the beginning of structural reorganization of crystalline at plastic deformation is connected with atomic volume redistribution. In fcc lattice of metals it is possible to allocate local formations having hcp configuration and being some kind of precursor of irreversible structural changes in the atomic lattice. It was show also, that a nonuniform distribution of stress fields in the loaded crystal with structural defects may lead to the implementation of complex deformation mechanisms, including the formation of dynamic defects, which lifetimes are comparable with the Debye times. These theoretical studies can help to extend our knowledge about the materials with a crystalline structure behavior under dynamic loading.
AB - The features of fcc metals atomic lattice structural reorganization under shift deformation are investigated. Mechanisms of deformation both for ideal crystalline and for a crystal containing various structural defects are analyzed. Investigations are carried out on the basis of computer simulations by mean of molecular dynamics method. It is shown that the beginning of structural reorganization of crystalline at plastic deformation is connected with atomic volume redistribution. In fcc lattice of metals it is possible to allocate local formations having hcp configuration and being some kind of precursor of irreversible structural changes in the atomic lattice. It was show also, that a nonuniform distribution of stress fields in the loaded crystal with structural defects may lead to the implementation of complex deformation mechanisms, including the formation of dynamic defects, which lifetimes are comparable with the Debye times. These theoretical studies can help to extend our knowledge about the materials with a crystalline structure behavior under dynamic loading.
KW - Atomic volume
KW - Defect formation
KW - Dynamic defect
KW - Plastic deformation
KW - Proto-defect
UR - http://www.scopus.com/inward/record.url?scp=84872552672&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=84872552672&partnerID=8YFLogxK
M3 - Article
AN - SCOPUS:84872552672
VL - 3
SP - 63
EP - 91
JO - International Journal of Terraspace Science and Engineering
JF - International Journal of Terraspace Science and Engineering
SN - 1943-3514
IS - 1
ER -