Loading...
Search for:
atomic-scale
0.007 seconds
Calculation of the Energy Release Rate of Nano-Cracks in FCC Materials Via the Many Body Atomic Scale FEM
, M.Sc. Thesis Sharif University of Technology ; Mohammadi Shodja, Hossein (Supervisor)
Abstract
Since the classical continuum theory fails to deal with the problems associated with defects, stress concentrators, and relevant deformation phenomena in solids, alternative approaches that can detect the atomistic nature of materials' fracture are required. The deficiency of the capture the size effect which yields delusively high values for some components of the stress field right on the edge of the stress concentrators, and its weakness in describing the complex interaction between small inhomogeneities, cracks and the like when they are only a few nanometers apart, are among some of the disadvantages of the classical approach. In recent years, however, atomistic methods are emerging to...
An Atomistic Study of the Interacting Crack and Coated Inhomogeneity
, M.Sc. Thesis Sharif University of Technology ; Mohammadi Shoja, Hossein (Supervisor)
Abstract
Classical continuum mechanics fails to give an accurate solution near the crack tip, moreover, it implies that a solid is able to sustain an infinite stress at the Griffith-Inglis crack tips. Among other critical issues is the inability of classical approach to sense the size effect. For these reasons, for more in-depth understanding and accurate behavioral predictions, it is essential to develop some atomistic methods which properly accounts, not only for the structure but also the long and short range atomic interactions effectively. In this work the interaction of coated inhomogeneity and crack under polynomial loading is simulated by using the many body Rafii-Tabar and Sutton potential...
Effects of the electric field configuration's variation due to micro-cantilever beam's curvature on pull-in phenomenon
, Article 2006 ASME International Mechanical Engineering Congress and Exposition, IMECE2006, Chicago, IL, 5 November 2006 through 10 November 2006 ; 2006 ; 1096665X (ISSN); 0791837904 (ISBN); 9780791837900 (ISBN) ; Ahmadian, M. T ; Sharif University of Technology
American Society of Mechanical Engineers (ASME)
2006
Abstract
Micro-electromechanical systems (MEMS) have wide application in the development of sensors for the detection of magnitudes in almost any domain [1]. Resonant mode operation of micro and nano-scale oscillators have gained wide interest for applications including filters, amplifiers, non-linear mixers, atomic scale imaging, biological and chemical sensors. The device that we propose is an electrically actuated microcantilever beam. More precisely, in our design the microcantilever constitutes the movable plate of a micro-capacitor and its displacement is controlled by the voltage applied across the plates. Review of literature shows that the electric field pattern between the beam and the...
Acquisition of high precision images for non-contact atomic force microscopy via direct identification of sample height
, Article 2005 ASME International Mechanical Engineering Congress and Exposition, IMECE 2005, Orlando, FL, 5 November 2005 through 11 November 2005 ; Volume 74 DSC, Issue 2 PART B , 2005 , Pages 1335-1342 ; 0791842169 (ISBN); 9780791842164 (ISBN) ; Jalili, N ; Meghdari, A ; Sharif University of Technology
2005
Abstract
Atomic force microscopes (AFM) can image and manipulate sample properties at the atomic scale. The non-contact mode of AFM offers unique advantages over other contemporary scanning probe techniques, especially when utilized for reliable measurements of soft samples (e.g., biological species). The distance between cantilever tip and sample surface is a time varying parameter even for a fixed sample height, and hence, difficult to identify. A remedy to this problem is to directly identify the sample height in order to generate high precision, atomic-resolution images. For this, the microcantilever is modeled by a single mode approximation and the interaction between the sample and cantilever...
The Effect of Structural Defects of Graphene Reinforced Polymer Nanocomposites on Mechanical Properties
, M.Sc. Thesis Sharif University of Technology ; Naghd Abadi, Reza (Supervisor)
Abstract
Nanocomposites are widely used due to unique properties such as low density and high strength in many industries such as electronics, telecommunications, aerospaces, Petrochemicals and shipbuildings. Meanwhile, due to the importance of economic issues, polymer based nanocomposites are the most used type of nanocomposites. The purpose of this thesis is studing the structural defects of graphene-reinforced nanocomposite polymers on the mechanical properties of these materials. Defects created in nanocomposites can be divided into two categories after construction. The first category is the defects that are created in the graphene structure when it is synthsis, and the second happen at the...
Atomic interactions between metallic tips and surfaces in NC-AFM
, Article Journal of Physics D: Applied Physics ; Volume 48, Issue 12 , February , 2015 ; 00223727 (ISSN) ; Sharif University of Technology
Institute of Physics Publishing
2015
Abstract
In this paper, the atomic-scale interactions between metallic tips and samples in noncontact atomic force microscopy (NC-AFM) are studied using molecular dynamics simulations. The effects of the tip and sample materials, the surface plane direction and the lateral position of the tip with respect to the sample, on the interaction force and the dissipated energy, are investigated. The simulations conducted demonstrate that, generally, we can classify the possible outcomes for the dynamics due to the tip-surface interactions into four major categories. The first category includes all cases in which there are no considerable instabilities in tip-surface interactions, leading to negligible...
On the design of graphene oxide nanosheets membranes for water desalination
, Article Desalination ; Volume 422 , 2017 , Pages 83-90 ; 00119164 (ISSN) ; Tavakoli, R ; Sharif University of Technology
Elsevier B.V
2017
Abstract
According to current researches, graphene oxide (GO) membranes show promising desalination properties due to ease of synthesis, low production cost, and high efficiency. There are several experimental works to study ionic sieving properties of GO membranes. However, it is difficult to characterize atomistic mechanism of water permeation and ion rejection by experimental approaches. On the other hand, there exist a few reports in which the atomistic picture of water permeation across GO membranes is investigated by means of molecular dynamics (MD) simulation. In the present work, in addition to water desalination, the atomic scale mechanism of ion rejection is studied using large scale MD...
Investigation of the atomic-scale hysteresis in NC-AFM using atomistic dynamics
, Article Physica E: Low-Dimensional Systems and Nanostructures ; Volume 42, Issue 8 , 2010 , Pages 2069-2077 ; 13869477 (ISSN) ; Meghdari, A ; Sharif University of Technology
2010
Abstract
In this paper, the hysteresis in the tipsample interaction force in noncontact force microscopy (NC-AFM) is measured with the aid of atomistic dynamics simulations. The observed hysteresis in the interaction force and displacement of the system atoms leads to the loss of energy during imaging of the sample surface. Using molecular dynamics simulations it is shown that the mechanism of the energy dissipation occurs due to bistabilities caused by atomic jumps of the surface and tip atoms in the contact region. The conducted simulations demonstrate that when a gold coated nano-probe is brought close to the Au(0 0 1) surface, the tip apex atom jumps to the surface, and instantaneously, four...