Sharif Digital Repository

Recently, some works have been done in studying activity network as a more realistic representation of users’ behavior in online social networks. However, there is a major deficiency of a suitable definition of activity network based on a comprehensive study of various activity networks separately and combined. The main purpose of our research is to understand the differences between users’ behavior by various Facebook activities, so as to claim that these networks should not be blindly composed; neither should the result of analyzing each of them individually be generalized to others. For this purpose, degree distribution, small-world phenomenon, degree correlation, reciprocity, and... 

Recently, some works have been done in studying activity network as a more realistic representation of users’ behavior in online social networks. However, there is a major deficiency of a suitable definition of activity network based on a comprehensive study of various activity networks separately and combined. The main purpose of our research is to understand the differences between users’ behavior by various Facebook activities, so as to claim that these networks should not be blindly composed; neither should the result of analyzing each of them individually be generalized to others. For this purpose, degree distribution, small-world phenomenon, degree correlation, reciprocity, and... 

Let n be a positive integer and let Sn be the set of all nonnegative integers less than n which are relatively prime to n. In this paper, we discuss structural properties of circulant graphs generated by the Sn’s and their complements. In particular, we characterize when these graphs are well-covered, Cohen–Macaulay, Buchsbaum or Gorenstein. © 2020, Springer Science+Business Media, LLC, part of Springer Nature  

The effect of graphene (G) and graphene oxide (GO), used as the nanofiller in polymer nanocomposites (NC), on the structural and dynamic properties of polymer chains, has been studied by means of molecular dynamics (MD) simulations. Two polymers, i.e., poly(propylene) and poly(vinyl alcohol), are employed as matrices to cover a wider range of polymer–filler interactions. The local structural properties, e.g., density profile, average Rg, and end-to-end distance as well as dynamic properties, e.g., estimated translational and orientational relaxation times, of polymer chains are studied. In addition, the interaction energies are estimated between polymers and nanofillers for different hybrid... 

In this paper, the bending modulus of a multi-layered graphene sheet is investigated using a geometrically based analytical approach. For this purpose, a bending potential energy is derived, based on the van der Waals interactions of atoms belonging to the two neighboring sheets of a double-layered graphene sheet. The inter-atomic spacing between the adjacent layers is determined along the line of action of the applied bending moments. The bending potential of the double-layered sheet is calculated by summing up the potentials at discrete hexagons over the length and width of the sheet. A multi-layered graphene sheet is considered as consisting of many stacking double-layers. It is observed... 

Nanomaterials are chemical compounds or substances which are moderately produced and used. Nanomaterials are engineered to reveal novel properties of nanocells that contrast with related non-visible substances, such as expanded consistency, conductivity or synthetic reaction. Topological indexes are quantities related to molecules that capture the harmony of molecular structures and give scientifically related properties, such as: viscosity, boiling point, radius of gravity, and so on. Their demands in genetics, chemistry, physics and nanoscience are infinite. The molecular topology of such compounds would be clarify by the quantitative structure properties relationship (QSPR) and... 

Sintering is a processing technique in which loose particles consolidate at elevated temperatures to form porous monoliths. Sintering is also a critical stage in recent additive manufacturing method like selective laser sintering. In this study, using an affordable alternative to X-ray tomography technique, we analyze the pore structure evolution in sintered parts made of nascent high-density polyethylene (HDPE) particles in terms of pore surface genus and pore surface curvature. Also, we investigate the underlying microstructural development and macroscopic properties of sintered parts. It is observed that pore structure and macroscopic permeability are strongly influenced by the... 

The present study deals with the structure-property relationship of organoclay (OC) filled nanocomposites based on rubber blend comprising of nitrile-butadiene rubber (NBR) and phenolic resin (PH). To obtain a better insight into the characteristics of the NBR/PH/OC hybrid system, a simple model system consisting of NBR/OC nanocomposites is also taken into consideration. A series of NBR/OC and NBR/PH/OC nanocomposites containing a wide range of OC concentrations (2.5-30 phr) are prepared by using traditional open two-roll mill. Structural analysis performed by X-ray diffraction (XRD), scanning electron microscope (SEM), and transmission electron microscope (TEM) exhibits mixed exfoliated and... 

In this study, the quantitative structure-property relationship method is applied to predict the enthalpy of fusion of pure chemical compounds at their normal melting point. A genetic algorithm-based multivariate linear regression is used to select the most statistically effective molecular descriptors for evaluating this property. To propose a comprehensive and predictive model, 3,846 pure chemical compounds are investigated. The root mean square of error and the average absolute deviation of the model are equal to 2.57 kJ/mol and 9.7%  

Social media usage is one of the most popular online activities and people shares millions of message in a short time; however this information rarely goes viral. The diffusion process begins with an initial set of source nodes and continues with other nodes. In addition, the viral cascade is triggered when the number of infected nodes exceeds a specific threshold. Then, we find an initial set of source nodes that maximizes the number of infected nodes given the source nodes. This study aims to answer the following questions: how does a spread like a viral cascade propagate in a network? Do the structural properties of the propagation pattern play an important role in virality? If so, can we... 

Quantitative structure-properties relationship (QSPR) has been applied to modelling and predicting the gas to acetone and gas to acetonitrile solvation enthalpies (ΔH Solv) of organic compounds using partial least squares (PLS), artificial neural network (ANN) and support vector machine (SVM) techniques. Two different datasets were assessed. The first one contained a set of gas to acetone enthalpy of solvation data of 68 different organic compounds while the second one included a total of 69 experimental data points for the enthalpy of solvation in acetonitrile. Genetic algorithm (GA) was used to search the descriptor space and select the descriptors responsible for property. After the... 

Density functional theory generalized gradient approximation has been used to calculate the electronic and structural properties of BaFe2As2 compound up to 56 GPa by using Quantum Espresso code. Structural properties like bulk modulus, Fe-As bond length, and As-Fe-As bond angles have been investigated by pressure especially near the tetragonal to collapsed tetragonal (T-cT) structural phase transition. This study shows considerable changes of these parameters in the cT phase, which happens near our calculated critical pressure, Pc = 24 ± 2 GPa. Electronic band structure and its orbital-resolved, total and partial density of states and Fermi surfaces have been... 

The adhesion of hydroxyapatite (HA) as a coating for the AZ91 magnesium alloy substrate can be improved by using the sputtering method and an intermediate layer, such as ZrN. In this study, HA coatings were applied on ZrN intermediate layers at a temperature of 300 °C for 180, 240, 300, 360, and 420 min by ion beam sputtering. A profilometer device was used to study the HA coating thickness, which changed from 2 μm for the 180-min deposition to 4.7 μm for 420-min deposition. The grazing incidence X-ray diffraction analysis method and the Williamson–Hall analysis were used for structural investigation. As the deposition time increased, the crystalline size increased from 50 nm to 690 nm.... 

Poly(vinyl alcohol) (PVA) is a biocompatible polymer which can be physically crosslinked by Borax to form hydrogel. PVA-Borax (PB) hydrogel is a promising candidate for drug delivery system. Therefore, it is necessary to find the quantitative relationship between drug release rate and network structure of PB hydrogels to predict and control drug release rate. In this work, at first step the optimum ratio of Borax: PVA was determined by studying the interactions between PVA chains and Borax molecules by means of Fourier transform infrared spectroscopy, while viscoelastic properties of prepared PB hydrogels were measured in the oscillatory shear flow field. In the following, curcumin as a... 

CuMS2 (M=A1, In, Fe) ternary compounds were synthesized via the facile polyol method in autoclave. Depending on the functional groups of solvent and surfactant, the structure of the nanocrystals can be controlled in the form of wurtzite or chalcopyrite. The chalcopyrite structure was obtained when the precursors solved in the mixture of diethylene glycol, polyethylene glycol 600 and ammonium hydroxide. When the solvent was replaced by ethylene diamine, the wurtzite was obtained along with chalcopyrite (polytypism). The products were characterized by X-Ray Diffraction (XRD) for analysis of structural properties, Transmission Electron Microscopy (TEM) for studying morphological... 

This work aims to develop a chemically modified sol–gel synthesis pathway for obtaining various barium titanate nanostructures. The method is able to prepare different BaTiO3 nanostructures such as highly stable nanoparticle embedded colloids, highly transparent amorphous nanolayers, nanocrystalline BaTiO3 powders and ultrathin BaTiO3 nanostructured films directly from a precursor solution. All the products have been prepared at a lower temperature and in a more cost-effective way in contrast to other established sol–gel methods. The results show that the optical transparency of the thin films has been significantly improved in contrast to the similar researches. The deposited thin film is... 

This article presents a new model for pricing a new product considering a skimming pricing strategy in the presence of competition. We consider two periods for price setting, including skimming and an economy period. The problem is to decide on skimming as well as economy price, in order to maximize total profit. The derived model is a non-linear programming model and we have analyzed the structure and properties of an optimal solution to develop a solution method. Analytical results, as well as managerial insights, are presented by mathematical and numerical analyses  

This article presents a new model for pricing a new product considering skimming pricing strategy in the presence of the competition. We consider two periods for price setting including skimming and economy period. The problem is deciding on a skimming price as well as an economy price in order to maximize the total profit. The derived model is a non-linear programming model and we analyzed the structure and properties of optimal solution to develop a solution method. Analytical results as well as managerial insights are presented by mathematical analysis and numerical analysis