LDPE/EVA/graphene nanocomposites with enhanced mechanical and gas permeability properties

In the present work, graphene oxide (GO) and reduced graphene oxide (RGO) were incorporated at low‐density polyethylene (LDPE)/ethylene vinyl acetate (EVA) copolymer blend using solution casting method. Monolayer GO with 1‐nm thickness and good transparency was synthesized using the well‐known Hummers's method. Fourier transform infrared and X‐ray photoelectron spectroscopy data exhibited efficient reduction of GO with almost high C/O ratio of RGO. Scanning electron microscopy showed the well distribution of GO and RGO within LDPE/EVA polymer matrix. The integrating effects of GO and RGO on mechanical and gas permeability of prepared films were examined. Young's modulus of nanocomposites are improved 65% and 92% by adding 7 wt% of GO and RGO, respectively. The tensile measurements showed that maximum tensile strength emerged in 3 wt% of loading for RGO and 5 wt% for GO. The measured oxygen and carbon dioxide permeability represented noticeably the attenuation of gas permeability in composite films compared with pristine LDPE/EVA blend. Copyright © 2015 John Wiley & Sons, Ltd.     

Correction to: 1H-imidazol-3-ium tricyanomethanide {[HIM]C(CN)3} as a nanostructured molten salt catalyst: application to the synthesis of pyrano[4,3‐b]pyrans

Research on Chemical Intermediates - Since it has been cleared that a fake compound has been sold to us as cyanoform.     

Efficient simulation of wave propagation in heterogeneous materials

In this contribution we explain the core idea of the recently proposed spectral cell method, which combines a fictitious domain approach with finite elements of high order and noticeably relieves the burden of mesh generation. Moreover, it employs mass lumping techniques and significantly reduces the computational expenditure. Our studies show that the spectral cell method leads to similar results yet with less computational effort as compared to standard techniques. These properties turn the method to a viable tool for the wave propagation analysis of structures that obey a complicated geometry. (© 2014 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim)     

On-line electrochemically controlled in-tube solid phase microextraction of inorganic selenium followed by hydride generation atomic absorption spectrometry

In this work, for the first time, a rapid, simple and sensitive microextraction procedure is demonstrated for the matrix separation, preconcentration and determination of inorganic selenium species in water samples using an electrochemically controlled in-tube solid phase microextraction (EC-in-tube SPME) followed by hydride generation atomic absorption spectrometry (HG-AAS). In this approach, in which EC-in-tube SPME and HG-AAS system were combined, the total analysis time, was decreased and the accuracy, repeatability and sensitivity were increased. In addition, to increases extraction efficiency, a novel nanostructured composite coating consisting of polypyrrole (PPy) doped with ethyleneglycol dimethacrylate (EGDMA) was prepared on the inner surface of a stainless-steel tube by a facile electrodeposition method. To evaluate the offered setup and the new PPy-EGDMA coating, it was used to extract inorganic selenium species in water samples. Extraction of inorganic selenium species was carried out by applying a positive potential through the inner surface of coated in-tube under flow conditions. Under the optimized conditions, selenium was detected in amounts as small as 4.0 parts per trillion. The method showed good linearity in the range of 0.012–200 ng mL⁻¹, with coefficients of determination better than 0.9996. The intra- and inter-assay precisions (RSD%, n = 5) were in the range of 2.0–2.5% and 2.7–3.2%, respectively. The validated method was successfully applied for the analysis of inorganic selenium species in some water samples and satisfactory results were obtained.     

Altermatic number of categorical product of graphs

In this paper, we prove some relaxations of Hedetniemi’s conjecture in terms of altermatic number and strong altermatic number of graphs, two combinatorial parameters introduced by the present authors Alishahi and Hajiabolhassan (2015) providing two sharp lower bounds for the chromatic number of graphs. In terms of these parameters, we also introduce some sharp lower bounds for the chromatic number of the categorical product of two graphs. Using these lower bounds, we present some new families of graphs supporting Hedetniemi’s conjecture.     

Numerical study on the effect of the injection pressure on spray penetration length

This paper investigates the fuel spray behavior and variation of the spray characteristics under different injection pressures in internal combustion engines. In diesel engines the fuel spray is affected by the cavitation phenomenon which occurs in the injector orifice. The cavitation is one of the important phenomena which has a significant effect on the fuel spray characteristics. In this paper, for a specified geometry of the nozzle and the combustion chamber, the effect of the cavitation phenomenon on the spray characteristics, i.e. spray penetration length, the Sauter main diameter and evaporation are studied numerically for different values of the injection pressures. High injection pressure causes high velocity of the fuel in the injector orifice which leads to an effective atomization process with small and dispersed fuel droplets. The fluid flow equations are calculated in the combustion chamber to obtain the spray model. Since it is known that, high injection pressure together with low discharge pressure leads to creation of cavitation phenomenon inside the injector orifice, then for having cavitation phenomenon inside the injector orifice and consequently for investigating the cavitation phenomenon effects on the spray characteristics, the injection pressure values of 10–150 MPa are considered while the discharge pressure remains constant. The injector and combustion chamber are simulated in separated regions and the results of the outlet of the nozzle are used as the boundary conditions for solving the fuel flow inside the combustion chamber to achieve the spray simulation. The results of this study show that by increasing the injection pressure, the value of the spray penetration length increases and the Sauter main diameter decreases for constant discharge pressure. The Hydraulic Flip phenomenon occurs after the injection pressure of 120 MPa on the base of the results of this work.     

Improvement of the thermoelectric efficiency of pyrene-based molecular junction with doping engineering

In this study, the thermoelectric properties of pyrene molecule doped with boron and nitrogen atom at different sites of molecule are investigated using density functional theory and none-equilibrium Green's function formalism in the linear response regime. Our calculations show that when the impurities are added to the edge of the molecule, the anti-resonant peaks will appear in the transmission diagram in the vicinity of the Fermi energy level. So it increases the thermoelectric figure of merit of the system in comparison with the one that the impurity is located in the center of molecule. Additionally,the seebeck coefficient signs are not the same among the B, N, and N B doped devices, indicating that the types of the carriers can be changed with different types of doping.     

A high-order enrichment strategy for the finite cell method

Thanks to the application of the immersed boundary approach in the finite cell method, the mesh can be defined independently from the geometry. Although this leads to a significant simplification of the mesh generation, it might cause difficulties in the solution. One of the possible difficulties will occur if the exact solution of the underlying problem exhibits a kink inside an element, for instance at material interfaces. In such a case, the solution turns out less smooth – and the convergence rate is deteriorated if no further measures are taken into account. In this paper, we explore a remedy by considering the partition of unity method. The proposed approach allows to define enrichment functions with the help of a high-order implicit representation of the material interface. (© 2015 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim)