Sharif Digital Repository

Nowadays, biocompatible composites are being utilized as scaffolds supporting cell growth promotion and features with the aim of organs regeneration or substitution based on tissue engineering principals. Moreover, in order to improve bioscaffolds features and function, various two-dimensional composite fillers have been under investigation; for instance, Graphene, Boron nitride, Metal dichalcogenides and oxides and black phosphorous and also electrospinning is mentioned as one of the most compatible and conventional processes of scaffold design that is also the main method of fabrication in this study. In addition, it should be pointed that biocompatible polymers and particularly natural... 

In this research, various molecular dynamics simulations have been carried out and sensitivity of the crack propagation process to the simulation parameters including the load pattern, maximum applied strain, temperature, loading frequency, and percentage of defects is investigated. Moreover, the crack propagation in poly-crystalline structure is studied using a larger model consisting of several atomic crystals and the effect of the presence of crystals on crack growth is investigated. In the next step, a novel coupling technique is developed in the continuum–atomistic multi-scale analysis of temperature field problems. In this manner, a new thermostat is introduced based on the single-atom... 

In the area of material studies, the atom structure models are the basis of all simulations and methods. With improvements in computers power, these models have become more consistent with experimental results. New theoretical methods combined with supercomputers assist to an understanding with detail and accuracy of material behavior at the atomic scale that leads to develop of the Computational Materials Science. Recently, developments in fields such as quantum mechanics, statistical physics, solid-state physics, quantum chemistry, computer science and graphics, allowed for faster computing which leads a powerful tool for material calculations and designs. New computer applications allow... 

In the last half century, the recording of the electrophysiological activities of the neurons has been one of the most effective methods for neuroscience development. One of the techniques used to record the activity of the nerve cells is the use of multi-electrode arrays (MEAs). Current MEAs still face limitations such as low signal-to-noise ratio (SNR) and low spatial resolution. There is a need to develop arrays that are smaller in size and have less impedance to achieve better spatial resolution and lower noise levels. The main focus of this research is on the designing and fabrication of multi-electrode arrays and improvement of their properties using nanostructures and conductive... 

The development of Nanotechnology increasingly has elevated the urgency for the expansion of modern numerical and computational methods that have evaluating systems with capability at this scale. In spite of being fully capable of evaluating nanostructures, the existing techniques, such as Molecular Dynamics Methods, lack the ability to simulate large systems of practical size and time scales. Thus, being able to create a large model of realistic simulation, which is confined by the computational expense of the running Molecular Dynamics methods at hand, Coarse-Graining technique has recently become a very effective and beneficial method which refers to the development of simplified models of... 

In these days world, the increasing growth of Nanotechnology has caused to invent and create new numerical and also computational methods which have more abilities and capabilities for evaluating systems in this scale. Although Some techniques, such as Molecular Dynamics Methods are capable of evaluating nanostructures, lack the ability to simulate large systems of practical size and time scales which is the most important index during the simulation. Therefore, in order to be able to produce an acceptable exact simulation of a large model, simulation of which is limited by the computational cost of the current molecular dynamics methods at hand, Coarse-Graining technique has recently become... 

Polypropylene (PP) is a fast growing polymer, particularly in automotive industry, where PP compounds have replaced many different parts made of conventional materials. In the first step, PP-g-MA, as compatibilizer, was synthesized. Two kinds of polypropylenes including a homo- and a block co-polymer were incorporated for this goal. Characterizations via titration and FTIR tests revealed higher degree of grafting reaction when homo-polymer was used for synthesizing PP-g-MA. In the next step, nanocomposites containing 3 wt% nanoclay with three different PP-g-MA/nanoclay ratios of 1:1, 2:1 and 3:1were made using a co-rotating twin screw extruder. Tensile, impact and XRD tests were performed to... 

Electric field sensors are one of the common types of sensors that are widely used today to record changes in the electric field in underwater environments, also record pH changes in different materials. This type of sensor is inspired by the shark mucous membrane. In this study, silver / silver chloride silver (Ag / AgCl) was used for three methods of silver filtration directly in electrolyte containing chloride ion, Electrophoretic electrode method and electrode making method using silver oxide adhesive. Part of the electrodes manufacturing method involves converting part of silver into silver chloride. The made electrode has a length of 7 cm and a diameter of 0.5 mm, with its core made of... 

In this study, the effect of nano-structure mesoporous supports on the performance of the nickel catalysts in the combined reforming process was investigated. In the first part, magnesium aluminate spinel was prepared using a sol-gel method and employed as a catalyst support for the preparation of nickel catalysts with various nickel contents. The samples were characterized using BET, XRD, TPR, TPO, CO chemisorption and SEM techniques. The results showed that increasing the nickel content up to 7.5 wt.% improved the catalytic activity, but further increase in nickel content decreased the activity due to the decrease in the nickel dispersion. The catalysts except of the sample with 2.5 wt.%... 

This investigation presents synthesis and characterization of pure and monophasic hydroxyapatite (Ca10(PO4)6(OH)2; HA) Nanostructures prepared by coral and oyster shell powders heated at 800 oC for 8 h as precursor via precipitation method. The morphology of HA nanostructures was controlled in the presence of various surfactants such as SDS, CTAB and PVP. The HA Nanorods synthesized by SDS were applied to fabricate bone scaffolds. Particle sizes of the HA Nanoparticles were about 20-30 nm. Pours three-dimensional HA/Ge/CMC scaffolds cross-linked by citric and oxalic acids were synthesized. In order to increase the pore size of the scaffolds, NaCl with medium (180-250 µm) and large (420-500... 

The microstructure, morphology and quality of the perovskite organic-inorganic layer as an absorber layer in perovskite solar cells has a significant role on the efficiency and energy conversion of the device. Different solvent engineering methods have been employed to prepare the perovskite layer with the desired properties and thier reproducibility have been studied. Herein, we applied a two-step solution approach by solvent engineering method, using solvents such as isopropyl alcohol, acetone and thier mixture, for preparation of lead iodide films. Moreover, their metallurgical and photovoltaic properties were investigated. The impact of solvent engineering, using solvents such as... 

The 21st century is facing two major obstacles on the way of accessing clean and renewable energies: first, the rapidly increasing need to the energy resources; and second, the limitations - as well as side-effects - of the conventional fossil fuels. Meanwhile, the production of the solar hydrogen, through water splitting, has been proposed as a promising solution to find a clean and effective source of energy. This process occurs in photo-electro-chemical systems with the activation energy that lies within the range of visible light. One approach that herewith comes to mind, is to start the process by utilizing semiconductors to absorb the sunlight. In order to overcome the overpotential... 

In this thesis, graphene/titanium oxide and graphene/tungsten oxide composites were synthesized using arc discharge in liquid and their photocatalytic behavior was studied. Based on physical principles of the arc discharge in liquid, geometry of point-point was used for metallic Ti and W electrodes. TiO2 and WO3 nanoparticles and their nanocomposites with graphene and graphene oxide (GO) were studies using DLS, UV-vis, PL, ICP, FTIR, XRD, Raman and TEM characterization. The concentration of aqueous solution of Rhodamine B mixed with graphene/WO3 and GO/WO3 composites and WO3 nanoparticles under ultraviolet light was measured versus time and reached to 0.1, 0.6 and 0.6 of the initial value... 

In the following research a novel method for vibration analysis of nano-structures has been presented. This method is based on equalizing the lattice stiffness to a continuous model. In this method, an equivalent continuous system is considered for each atomic lattice and for the equivalent system a modified differential equation is presented. The governing equation of the continuous system is modified in such a way that the displacement field of the atomic lattice obtained by solving this differential equation gives similar responses to the displacement field of atomic lattice. This differential equation is derived from the Taylor expansion of the displacement field about the lattice atoms.... 

For realization of nanosale photonic device required by the future system, electron beams, and scanning probe microscopes have been used to control the site on the subtrate. However, these techniques have a fatal disadvantage because they cannot deal with insulators and Diffraction of light, limiting their application.To overcome this difficulties, we design and implement near-field optical chemical vapor deposition, which enables the fabrication of nanometer-scale structure, while controlling their position. To guarantee that an optical near field is generated sufficiently, we fabricated a sharped W-tip by electrochemical etching. The separation between the W-tip and the substrate was kept... 

In this study, ternary metal oxide coating consisting of Ti, Ru, Ir were prepared by sol-gel method. In order to achieve optimal conditions, the effect of number of layers, temperature and velocity of the heat treatment, the amount of ruthenium and iridium, polymeric additive on the coating and also, comparisons of binary and ternary oxide coatings were studied. The corrosion behavior was examined by anodic polarization and cyclic voltammetry tests and accelerated stability test (AST), the morphology of coatings was studied by field emission scanning electron microscopy (FESEM), phase and elemental analysis was performed using X-ray diffraction (XRD) and energy dispersive spectroscopy... 

The need for better characterization systems (electron microscopes) and high resolution lithography systems, have made electron beams systems an interesting choice for research and development. In fact, all of the above applications require ideal electron beams (beams with minimum energy spread, maximum current density, and minimum spotsize), and electron-optic lenses (simple lenses with minimum aberration). In this research, theoretical aspects of electron emission and lens systems are reviewed. Field emission array (FEA) electron guns are introduced as electron sources with minimum energy spread, and a new simulation method is presented in order to minimize the complexity, and reduce the... 

Graphene oxide is a single sheet of Carbon atoms which has been arranged on a two-dimensional honeycomb lattice. Functional groups such as epoxy, carboxyl and carbonyl are located on basal plane and at the edges of graphene oxide and they localize electrons on the surface of graphene oxide and open band gap in its band structure. Pure graphene has zero band gap, so existence of fluorescence properties is unlikely; but graphene oxide has fluorescence properties due to band gap in its band structure. Fluorescence properties of graphene have been used in live cell imaging and drug delivery, so study and increasing of fluorescence properties is significantly important. The purpose of this... 

NiTi is known as a most important material for manufacturing implants and other medical devises duo to its shape memory and super elasticity properties, high energy damping and high corrosion resistance.In this project the possibility of producing nano structured NiTi implant with high porosity was investigated. For reaching to nano scale mechanical alloying process was done on Ti and Ni powder as row materials. Mechanical alloying process and the possibility of reaching nano structure or amorphous phase was investigated. Space holder technic was used for reaching a porous structure. Sintering process was planned in a way to inhibit grain growth as much as possible. The samples sintered in... 

This thesis demonstrate a new hybrid Plasma Electrolytic Oxidation (PEO)-Hydrothermal method to produce a nano-structured TiO2 layer over a titanium substrate. Microstructural characterization was carried out by using a FE-SEM to explore nano scale structural changes due to hydrothermal treatment. More over EDS was used to analyse elements of the coating. The FE-SEM images confirmed formation of a 3D network consisting “nano flakes+nano fibers”after 6 or 12 hours and a ”sea urchin like nanostructure+nano fibers” after 24 hour. To improve the performance of nano-structured photoelectrodes, different electrolytes were studied to achieve maximum amount of anatase phase. the best results was...