Sharif Digital Repository

The misfit strain within the core of a two-phase free-standing core-shell nanowire resulting in the generation of an edge misfit dislocation or an edge misfit dislocation dipole at the core-shell interface is considered theoretically within both the classical and surface/interface elasticity approaches. The critical conditions for the misfit dislocation generation are studied and discussed in detail with special attention to the non-classical surface/interface effect. It is shown that this effect is significant for fine cores of radius smaller than roughly 20 interatomic distances. The positive and negative surface/interface Lamé constants mostly make the generation of the misfit dislocation... 

The elastic behavior of an edge dislocation placed in the shell of a free-standing core-shell nanowire is considered within the theory of surface/interface elasticity. Using the method of complex potential functions the expressions for the stress field of the dislocation, image forces on the dislocation, and the dislocation strain energy are derived and studied in detail. A special attention is paid to non-classical effects revealed within the surface/interface elasticity approach where a characteristic length parameter referred to as surface/interface modulus is introduced. These effects are (i) the stress oscillations along the shell surface and core-shell interface for negative values of... 

The problem of edge dislocation inside the wall of a multi-walled nanotube accounting for the surface effects is addressed. Within the framework of surface elasticity the stress field is obtained, using complex potentials. Furthermore, the stress field and image forces acting on the dislocation, with and without an account of the surface stress, are compared together and discussed  

Molecular dynamics simulations were used to propose a closed-form expression for the mobility of the [Formula presented] edge dislocation in low-carbon α-Fe (up to 0.1 at.% C) at temperatures of 300, 400 and 500 K and applied shear stresses of 10–100 MPa. Considering this parameter helps us to understand the effect of damage cascade on the dislocation mobility. The results confirmed that the point defect clusters at the thermal spike stage of the cascade (that they can be considered as an unstable precipitation-like phase), the distance of damage cascade relative to the center of the dislocation core and forming carbon-vacancy (C–V) complexes are some rather stronger obstacles for movement... 

The elastic behavior of an edge dislocation located inside the core of a core-shell nanowire which is embedded in an infinite matrix is studied within the surface/interface elasticity theory. The corresponding boundary value problem is solved exactly by using complex potential functions. An important parameter so-called interface characteristic parameter which has the dimension of length and is a combination of the interface moduli enters the formulations. The stress field of the dislocation, image force acting on the dislocation, and the dislocation strain energy is calculated by considering the interface effect. The introduced characteristic parameter allows the examination of the... 

The elastic behaviors of a two-axes dipole of wedge disclinations and an individual wedge disclination located inside the shell of a free standing core-shell nanowire is studied within the surface/interface elasticity theory. The corresponding boundary value problem is solved using complex potential functions, defined through modeling the disclination dipole by two finite walls of infinitesimal edge dislocations. The stress field, disclination strain energies and image forces acting on the disclinations, are calculated and studied in detail. It is shown that the stresses are rather inhomogeneous across the nanowire cross section, change their signs and reach local maxima and minima far from... 

The elastic behavior of an edge dislocation, which is positioned outside of a nanoscale elliptical inhomogeneity, is studied within the interface elasticity approach incorporating the elastic moduli and surface tension of the interface. The complex potential function method is used. The dislocation stress field and the image force acting on the dislocation are found and analyzed in detail. The difference between the solutions obtained within the classical-elasticity and interface-elasticity approaches is discussed. It is shown that for the stress field, this difference can be significant in those points of the inhomogeneity-matrix interface, where the radius of curvature is smaller and which... 

A new model on the evolution of dislocation structure of cell forming metals and alloys through severe plastic deformation is presented. Following previous approaches, the model considers a cellular dislocation structure consisted of two phases: cell interiors and cell walls. The model distinguishes edge and screw dislocations in terms of three categories: mobile dislocations, immobile dislocations in cell interiors and immobile dislocations in cell walls. Then considering physical and geometrical assumptions for each dislocation category, an evolutional law is derived, based on some dislocation interaction mechanisms such as dislocation generation, annihilation, locking and migration. The... 

In this paper, a hierarchical multi-scale technique is developed to investigate the thermo-mechanical behavior of nano-crystalline structures in the presence of edge dislocations. The primary edge dislocations are generated by proper adjustment of atomic positions to resemble discrete dislocations. The interatomic potential used to perform atomistic simulation is based on the Finnis-Sinclair embedded-atom method as many-body potential and, the Nose-Hoover thermostat is employed to control the effect of temperature. The strain energy density function is obtained for various representative volume elements under biaxial and shear loadings by fitting a fourth order polynomial in the atomistic... 

Eringen's nonlocal theory and an accurate determination of the nonlocal kernel functions for hexagonal close-packed (hcp) crystals are of interest. The kernel functions are closely related to the anisotropy as well as any crystalline symmetries. To this end, five new distinct nonlocal kernel functions which have the characteristics of discrete atomistic Green's functions in the stress space are obtained through consideration of the nonlocal dispersion relations associated with certain directions combined with ab initio Density Functional Perturbation Theory (DFPT) calculations of the pertinent phonon frequencies. This is the first work which provides the nonlocal hcp kernel functions...