Abstract
The paper undertakes a study of plastic deformation in a titanium crystallite under mechanical loading (uniaxial tension and indentation) in terms of atomic mechanisms of its generation and development. The molecular dynamics method with many-body interatomic potentials is employed. It is shown that there is a threshold strain, at which a crystal reveals the generation of local structural transformations associated with changes in atomic configurations of the first and second coordination spheres. The onset of plastic deformation in a crystallite is accompanied by a stepwise decrease in potential energy. The effect of free surfaces and grain boundaries on the generation of local structural transformations in a titanium crystallite is investigated.
| Original language | English |
|---|---|
| Title of host publication | AIP Conference Proceedings |
| Publisher | American Institute of Physics Inc. |
| Pages | 675-678 |
| Number of pages | 4 |
| Volume | 1623 |
| ISBN (Print) | 9780735412606 |
| DOIs | |
| Publication status | Published - 2014 |
| Event | International Conference on Physical Mesomechanics of Multilevel Systems 2014 - Tomsk, Russian Federation Duration: 3 Sep 2014 → 5 Sep 2014 |
Other
| Other | International Conference on Physical Mesomechanics of Multilevel Systems 2014 |
|---|---|
| Country | Russian Federation |
| City | Tomsk |
| Period | 3.9.14 → 5.9.14 |
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Keywords
- Molecular dynamics
- Nanoindentation
- Structural defects
ASJC Scopus subject areas
- Physics and Astronomy(all)
Cite this
Investigation of defect nucleation in titanium under mechanical loading. / Zolnikov, Konstantin P.; Korchuganov, Aleksandr V.; Kryzhevich, Dmitrij S.; Psakhie, Sergey G.
AIP Conference Proceedings. Vol. 1623 American Institute of Physics Inc., 2014. p. 675-678.Research output: Chapter in Book/Report/Conference proceeding › Conference contribution
}
TY - GEN
T1 - Investigation of defect nucleation in titanium under mechanical loading
AU - Zolnikov, Konstantin P.
AU - Korchuganov, Aleksandr V.
AU - Kryzhevich, Dmitrij S.
AU - Psakhie, Sergey G.
PY - 2014
Y1 - 2014
N2 - The paper undertakes a study of plastic deformation in a titanium crystallite under mechanical loading (uniaxial tension and indentation) in terms of atomic mechanisms of its generation and development. The molecular dynamics method with many-body interatomic potentials is employed. It is shown that there is a threshold strain, at which a crystal reveals the generation of local structural transformations associated with changes in atomic configurations of the first and second coordination spheres. The onset of plastic deformation in a crystallite is accompanied by a stepwise decrease in potential energy. The effect of free surfaces and grain boundaries on the generation of local structural transformations in a titanium crystallite is investigated.
AB - The paper undertakes a study of plastic deformation in a titanium crystallite under mechanical loading (uniaxial tension and indentation) in terms of atomic mechanisms of its generation and development. The molecular dynamics method with many-body interatomic potentials is employed. It is shown that there is a threshold strain, at which a crystal reveals the generation of local structural transformations associated with changes in atomic configurations of the first and second coordination spheres. The onset of plastic deformation in a crystallite is accompanied by a stepwise decrease in potential energy. The effect of free surfaces and grain boundaries on the generation of local structural transformations in a titanium crystallite is investigated.
KW - Molecular dynamics
KW - Nanoindentation
KW - Structural defects
UR - http://www.scopus.com/inward/record.url?scp=84915819832&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=84915819832&partnerID=8YFLogxK
U2 - 10.1063/1.4899035
DO - 10.1063/1.4899035
M3 - Conference contribution
AN - SCOPUS:84915819832
SN - 9780735412606
VL - 1623
SP - 675
EP - 678
BT - AIP Conference Proceedings
PB - American Institute of Physics Inc.
ER -