Effects of Strain Rate, Temperature and Grain Size on the Mechanical Properties and Microstructure Evolutions of Polycrystalline Nickel Nanowires: A Molecular Dynamics Simulation
- 17 May 2018
- journal article
- engineering science
- Published by EDP Sciences in Wuhan University Journal of Natural Sciences
- Vol. 23 (3), 251-258
- https://doi.org/10.1007/s11859-018-1318-x
Abstract
Through molecular dynamics (MD) simulation, the dependencies of temperature, grain size and strain rate on the mechanical properties were studied. The simulation results demonstrated that the strain rate from 0.05 to 2 ns–1 affected the Young’s modulus of nickel nanowires slightly, whereas the yield stress increased. The Young’s modulus decreased approximately linearly; however, the yield stress firstly increased and subsequently dropped as the temperature increased. The Young’s modulus and yield stress increased as the mean grain size increased from 2.66 to 6.72 nm. Moreover, certain efforts have been made in the microstructure evolution with mechanical properties association under uniaxial tension. Certain phenomena such as the formation of twin structures, which were found in nanowires with larger grain size at higher strain rate and lower temperature, as well as the movement of grain boundaries and dislocation, were detected and discussed in detail. The results demonstrated that the plastic deformation was mainly accommodated by the motion of grain boundaries for smaller grain size. However, for larger grain size, the formations of stacking faults and twins were the main mechanisms of plastic deformation in the polycrystalline nickel nanowire.Keywords
This publication has 29 references indexed in Scilit:
- Molecular dynamics evaluation of strain rate and size effects on mechanical properties of FCC nickel nanowiresComputational Materials Science, 2011
- Nickel nanowires under uniaxial loads: A molecular dynamics simulation studyComputational Materials Science, 2008
- Nanowire-based electromechanical biomimetic sensorPhysica E: Low-dimensional Systems and Nanostructures, 2006
- Dynamic range of nanotube- and nanowire-based electromechanical systemsApplied Physics Letters, 2005
- The uniaxial tensile deformation of Ni nanowire: atomic-scale computer simulationsPhysica E: Low-dimensional Systems and Nanostructures, 2004
- Ultrahigh Strength and High Electrical Conductivity in CopperScience, 2004
- Length scale effects in the simulation of deformation properties of nanocrystalline metalsScripta Materialia, 2002
- Large deformation and amorphization of Ni nanowires under uniaxial strain: A molecular dynamics studyPhysical Review B, 2000
- Nanostructured materials: basic concepts and microstructureActa Materialia, 2000
- One-dimensional nanostructures: Chemistry, physics & applicationsSolid State Communications, 1998