Sharif Digital Repository

Certain physical and mechanical phenomena within ultra-thin face-centered cubic (fcc) films containing common types of interacting point defects are addressed. An atomic-scale lattice statics in conjunction with many-body interatomic potentials suitable for binary systems is conducted to analyze the effects of the depth on the: (1) formation energy and layer-by-layer displacements due to the presence of vacancy-octahedral self-interstitial atom (OSIA) ensemble, and (2) elastic fields as well as the free surface shape in the case of vacancy-dopant interaction. Moreover, the effects of the inter-defect spacing for various depths are also examined. To ensure reasonable accuracy and numerical... 

The effect of surface and interface elasticity in the analysis of the Saint-Venant torsion problem of an eccentrically two-phase fcc circular nanorod is considered; description of the behavior of such a small structure via usual classical theories cease to hold. In this work, the problem is formulated in the context of the surface/interface elasticity. For a rigorous solution of the proposed problem, conformal mapping with a Laurent series expansion are employed together. The numerical results well illustrate that the torsional rigidity and stress distribution corresponding to such nanosized structural elements are significantly affected by the size. In order to employ surface and interface... 

The effect of surface and interface elasticity in analysis of the Saint-Venant torsion problem of an eccentrically two-phase circular nanobar is considered. The problem is formulated in the context of Gurtin's surface elasticity. For a rigorous solution of the proposed problem, conformal mapping together with a Laurent series expansion are employed. At the nanoscales the usual classical theories cease to hold and the corresponding results deteriorate. The numerical results well illustrate that the torsional rigidity of the mentioned nanosized structural elements are significantly affected by the size. Some applications of the given results can be contemplated in the design of micro/nano... 

Preformed particle gels (PPGs) in solutions have been widely used to suppress excess water production in mature oil reservoirs and, in turn, to improve the amount of oil recovery in brown oil fields. In this study, PPG solutions were meticulously formulated and synthesized in order to be utilized in harsh environments in terms of pressure, temperature, pH, and salinity from a free radical polymerization process. In this work, nanosilica gel at different weight percentages was added to improve the mechanical and thermal stability properties of the PPG at harsh condition: high pressure, temperature, and strain. Moreover, the effects of nanosilica gel at various concentrations, ranging from 0.0... 

The objective of this work is to develop a new Preformed Particle Gel (PPG) suspension to enhance oil production and monitor water production in a porous medium on micromodel scale. To achieve the above goal, the following synthetic method was used. At the outset, the PPG samples were synthesized with polyethylene amine (PEI) as a crosslinker, 2,2′-Azobis (2-methylpropionamidine) dihydrochloride (AAPH) as initiator and acrylamide (AM) and 2-Acrylamido-2-methylpropanesulfonic acid (AMPS) monomers to improve the strength properties of PPGs by the radical polymerization method. Also, to characterize the micro and macro structural the samples, the scanning electron microscopy (SEM),... 

The petroleum industry suffers from reservoir souring phenomena, which has negative impacts on production facilities, health, and environment. Injection of incompatible water into the reservoir (waterflooding), which is considered as an enhanced oil recovery (EOR) method, is one of the most common causes of reservoir souring. In general, injected brine, especially seawater, contains high amounts of sulfate ion (SO42−). A high concentration of sulfate in the presence of sulfate-reducing bacteria (SRB) leads to the microbial reservoir souring. During this phenomenon, sulfide, specifically hydrogen sulfide gas (H2S) appears in the producing fluid of the reservoir. In this paper, a coupled... 

The liver plays a complex role in metabolism and detoxification, and better tools are needed to understand its function and to develop liver-targeted therapies. In this study, we establish a mechanobiological model of liver transport and hepatocyte biology to elucidate the metabolism of urea and albumin, the production/detoxification of ammonia, and consumption of oxygen and nutrients. Since hepatocellular shear stress (SS) can influence the enzymatic activities of liver, the effect of SS on the urea and albumin synthesis are empirically modeled through the mechanotransduction mechanisms. The results demonstrate that the rheology and dynamics of the sinusoid flow can significantly affect... 

A new efficient catalytic system was investigated for the epoxidation of various olefins by cis-dioxo-bis[2-(2′-hydroxyphenyl)-oxazolinato]molybdenum(VI), cis-[MoO2(phox)2], and TBHP as oxidizing agent. Using this system as catalyst for the oxidation of aliphatic substrates at 80 °C gives the epoxide as the sole product with yields up to 100% and turnover frequency up to 5000 h-1. The efficiency of the catalyst is strongly influenced by the nature of solvent, reaction time and temperature, and a significant increase in the epoxide yields is observed in higher temperatures and longer reaction times. © 2009 Elsevier B.V  

Ostracism has been recognized as conceptually and empirically distinct from harassment. Drawing from theory and research that suggests that employees have a strong need to belong in their organizations, we examine the comparative frequency and impact of ostracism and harassment in organizations across three field studies. Study 1 finds that a wide range of employees perceive ostracism, compared with harassment, to be more socially acceptable, less psychologically harmful, and less likely to be prohibited in their organization. Study 2 surveyed employees from a variety of organizations to test our theory that ostracism is actually a more harmful workplace experience than harassment.... 

This work presents an innovative design for a flow-through dielectrophoretic cell sorting based on silicon bulk microelectrodes featuring sidewall undercuts. The microelectrodes are configured into an interdigitated array with digits extending across the flow chamber at an oblique angle against the flow stream. Target cells under dielectrophoretic forces and hydrodynamic drag can slide along the digits to a dedicated outlet. The design has been showcased for continuous-flow sorting of viable and non-viable mammalian cells, achieving a throughput of 16,600 cells/min, an order of magnitude higher than those reported for existing continuous-flow cell sorting designs using thin-film or... 

The search for efficient chemotherapy drugs and other anti-cancer treatments would benefit from a deeper understanding of the tumor microenvironment (TME) and its role in tumor progression. Because in vivo experimental methods are unable to isolate or control individual factors of the TME and in vitro models often do not include all the contributing factors, some questions are best addressed with systems biology mathematical models. In this work, we present a new fully-coupled, agent-based, multi-scale mathematical model of tumor growth, angiogenesis and metabolism that includes important aspects of the TME spanning subcellular-, cellular- and tissue-level scales. The mathematical model is... 

Sets of rosettes of stress probes have been performed on Hostun sand in a flexible boundary true triaxial apparatus. These have shown the effect of stress history on the local distortional stiffness of the sand. Histories have included isotropic compression, and deviatoric paths with increasingly complex shapes. These tests were performed and interpreted against a background of kinematic hardening and bounding surface plasticity, using stress response envelopes to reveal evolving distortional stiffness. Use of response envelopes to study volumetric stiffness appears to be less helpful but the phase transformation surfaces that can be extracted seem somewhat independent of recent stress... 

Atomic emission detection (AED) is a sensitive as well as a selective detection technique for gas chromatography (GC) and provides element-specific information. A rapidly increasing number of applications in many different areas illustrates the versatility and analytical power of the technique - especially when complex samples have to be analysed. The complementary use of GC-AED and GC with mass-spectrometric detection often yields the most rewarding results. © 2002 Published by Elsevier Science B.V. All rights reserved  

Oil spills are serious environmental issues that potentially can cause adverse effects on marine ecosystems. In some marine areas, like the Baltic Sea, there is a large number of wrecks from the first half of the 20th century, and recent monitoring and field work have revealed release of oil from some of these wrecks. The risk posed by a wreck is governed by its condition, hazardous substances contained in the wreck and the state of the surrounding environment. Therefore, there is a need for a common standard method for estimating the risks associated with different wrecks. In this work a state-of-the-art model is presented for spatial and stochastic risk assessment of oil spills from... 

A resin-bound 1,2,4-triazolium ionic tag has been used as support for the preparation of solid palladium nanoparticles (Pd(0)-POLI-TAG-Pd). Owing to the pincer-type architecture of the triazolium ligand, the stabilization of a high amount of palladium nanoparticles (16 wt %) has been possible. The catalytic system has been fully characterized and used in low amounts (i.e., 0.1 mol % palladium loading) in representative Heck-Mizoroki cross-coupling processes. A negligible release of the metal was demonstrated, and a high activity was obtained over more runs. Besides, the protocol has been optimized for the use of safe biomass-derived γ-valerolactone reaction medium  

Novel molybdenum complex, cis-[MoO2(phox)2] has been synthesized and characterized by IR, 1H NMR, elemental analyses (CHN), and X-ray molecular structure determination methods. This complex was found to be an efficient, selective catalyst for the oxidation of various sulfides to sulfoxides with urea hydrogen peroxide (UHP) in excellent yields (100% for diallylsulfide) and short reaction times (20 min) at room temperature. The catalytic system oxidizes diallylsulfide chemoselectively to its corresponding sulfoxide without any over oxidation in double bond. © 2007 Elsevier B.V. All rights reserved  

In order to generate adequate electricity energy, conventional power plants utilize dramatic volume of water resources. Different methods such as replacing cutting-edge technologies of facilities have been proposed to diminish water consumption in this industry. Most of the approaches are considered as medium or long-term solution which requires substantial investment costs. Meanwhile, because of the process and technology, natural gas-fired power plants need less water among conventional power plants. Therefore, shifting unit commitment planning toward these power plants would aid to save water consumption. Nevertheless, overlooking combined cycle power plants can perform negative impact on... 

Understanding the time water takes as it moves from rain or snowmelt through the terrestrial system to arrive as stream discharge, or evapotranspiration (ET) is an important hydrologic quantity. We develop a Lagrangian particle tracking method to capture transient residence times from source to either ET or outflow in an integrated hydrologic model. This method is parallel and efficiently captures time evolution of parcels of water in the model and tracks the source of water for hydrograph or ET separation. We demonstrate this model using hypothetical hillslope simulations driven by snow or rain dominated forcing and two different land cover types. We show that land cover and forcing both...