Supertough (Polyamide 6)/(acrylonitrile butadiene rubber) nano alloy through in situ polymerization of caprolactam in the presence of acrylonitrile butadiene rubber nanophase

In this work, polymerization of caprolactam (CL) was carried out in the presence of acrylonitrile butadiene rubber (NBR) during the reactive melt‐mixing process. During shear mixing, NBR particles swelled and dissolved in the molten CL, which led to separation and distribution of rubber particles to nanoscale in the dissolution stage. Then, in an internal mixer, supertough Polyamide 6 was prepared via melt polymerization of CL/NBR mixture, sodium caprolactam as a catalyst, and hexamethylene diisocyanate as an activator. The effects of various concentrations of catalyst and activator on the initiation time of the reaction were determined. Physical and mechanical properties of different formulations prepared via reactive melt blending were determined by tensile and impact measurements, differential scanning calorimetry, Fourier‐transform infrared spectroscopy, X‐ray scattering techniques, transmission electron microscopy, and dynamic mechanical thermal analysis. Experimental results showed that a recipe with 3% nitrile rubber in a CL/NBR mixture enhances the physical and mechanical properties the best, compared with other formulations. This condition led to the formation of NBR nanospheres during melt polymerization of Polyamide 6 as well. J. VINYL ADDIT. TECHNOL., 21:116–121, 2015. © 2014 Society of Plastics Engineers     

Flow of nanodispersed catalyst particles through porous media: Effect of permeability and temperature

The proposed in situ catalytic upgrading of heavy oil to achieve an environmentally sustainable method for heavy oil recovery requires the placement of nanodispersed catalyst particles deep into the formation where it can accelerate the high‐temperature upgrading reactions. In continuation of the previous work [Zamani et al., Energy Fuels 24, 4980‐4988 (2010)], this paper presents results of several new experiments carried out to examine the effects of other parameters, including the connate brine salinity, absolute permeability, sand‐bed temperature and particle concentration on the propagation of nanoparticles in porous media. The results show that lower permeability, increased operating temperature and higher particle concentration did not significantly affect the propagation of nanodispersed catalyst suspension through the sand‐bed. Virtually the same filtration behaviour, displaying a rapid increase of effluent concentration at 1 pore volume injected to a steady concentration close to the inlet concentration was seen in all experiments. A classical phenomenological approach was used to model the macroscopic propagation behaviour of suspended particles in the porous medium. The model was successful in history matching the effluent composition profile observed in the experiments and the deposition profile obtained from post‐test analysis of the sand‐bed. © 2011 Canadian Society for Chemical Engineering     

Thermal stability of some flavonoids and phenolic acids in sheep tallow olein

In this study, the thermal stability of some phenolic antioxidants including flavonoids (quercetin and catechin) and phenolic acids (gallic acid, tannic acid, ellagic acid and caffeic acid) in tallow olein was investigated. Tallow olein fractionated from sheep tallow fat was used as a medium to study the antioxidant activity at 120, 140, 160 and 180°C. In order to extract tallow olein, a three‐stage fractionation method was performed on sheep tallow fat at the constant temperatures of 25, 15 and 5°C using acetone as a solvent. The results suggested that quercetin and ellagic acid had the highest thermal stability amongst others, while gallic acid and caffeic acid exhibited the least thermal stability. Practical applications: The sheep tallow fat has been primarily used in soap manufacturing and its application as an edible fat has been limited due to its high content of saturated fatty acids. Extraction of the liquid phase of tallow fat (tallow olein) by fractionation reduces its long‐chain saturated fatty acid content to an acceptable level for edible consumption. The fractionation process, as negatively affects the stability to autoxidation, should be followed by stabilisation with antioxidants. The recent interest in natural antioxidants encouraged the authors to investigate the thermal stability of phenolic antioxidants in tallow olein. It is necessary to determine the thermal stability of antioxidants to predict their appropriateness to be used in high‐temperature applications such as deep frying. Fractionation and stabilisation with appropriate antioxidants are the important steps to utilise tallow olein as an edible oil for different applications in salad formulations, cooking and frying.     

Synthesis,structure, and thermo‐physical properties of Fe2O3.Al2O3 and polyethylene nanocomposites

In this study, Fe₂O₃.Al₂O₃/polyethylene composites were prepared using a two‐step process. In the first step, PE is synthesized using titanium based metallocene catalyst system. While the synthesized PE was subsequently purified, hydrated alumina filled PE (MHFP) composites was formed by the hydrolysis of methylaluminoxane (MAO). In the second step, Fe₂O₃.Al₂O₃/PE was prepared via thermal decomposition of ferric formate in a high temperature solution of MHFP composite. The structure, morphology, and thermal properties of the composites were characterized using the XRD, FTIR, SEM‐EDX, TGA, and DSC analytical techniques. Results showed that the incorporation of a suitable amount of Fe₂O₃.Al₂O₃ into the composites enhances the thermal stability. © 2011 Wiley Periodicals, Inc. J Appl Polym Sci, 2011     

Experimental study of CO2 absorption/stripping via PVDF hollow fiber membrane contactor

Gas–liquid hollow fiber membrane contactor can be a promising alternative for the CO₂ absorption/stripping due to the advantages over traditional contacting devices. In this study, the structurally developed hydrophobic polyvinylidene fluoride (PVDF) hollow fiber membranes were prepared via a wet spinning method. The membranes were characterized in terms of morphology, permeability, wetting resistance, overall porosity and mass transfer resistance. From the morphology analysis, the membranes demonstrated a thin outer finger-like layer with ultra thin skin and a thick inner sponge-like layer without skin. The characterization results indicated that the membranes possess a mean pore size of 9.6 nm with high permeability and wetting resistance and low mass transfer resistance (1.2 × 10⁴ s/m). Physical CO₂ absorption/stripping were conducted through the fabricated gas–liquid membrane contactor modules, where distilled water was used as the liquid absorbent. The liquid phase resistance was dominant due to significant change in the absorption/stripping flux with the liquid velocity. The CO₂ absorption flux was approximately 10 times higher than the CO₂ stripping flux at the same operating condition due to high solubility of CO₂ in water as confirmed with the effect of liquid phase pressure and temperature on the absorption/stripping flux.     

Quantum chemical studies on corrosion inhibition for series of thio compounds on mild steel in hydrochloric acid

Quantum chemical calculations were performed on ten thio compounds using semi-empirical method PM3 within program package of Material Studio 5.5. The effect of molecular structure on the corrosion inhibition efficiency was investigated using the quantum chemical calculations. The electronic properties such as highest occupied molecular orbital (HOMO), lowest unoccupied molecular orbital (LUMO) energy levels, (LUMO–HOMO) energy gap, dipole moment (λ) and fraction of electron transfer (ΔN) were calculated and discussed. A relationship between the corrosion inhibition efficiency and several quantum parameters was established with coefficient correlation (R²) of 0.8894.     

Polyamide 66 microspheres metallised with in situ synthesised gold nanoparticles for a catalytic application

A simple concept is proposed to metallise polyamide 66 (PA66) spherulite structures with in situ synthesised gold nanoparticles (Au NPs) using a wet chemical method. This cost-effective approach, applied to produce a PA66/Au NP hybrid material, offers the advantages of controlling the nanoparticle size, the size distribution and the organic-inorganic interactions. These are the key factors that have to be controlled to construct consistent Au nanostructures which are essential for producing the catalytic activities of interest. The hybrid materials obtained are characterised by means of scanning electron microscopy, transmission electron microscopy, attenuated total reflection-Fourier transform infrared spectrometry and X-ray diffraction spectrometry. The results show that PA66 microspheres obtained via the crystallisation process are coated with Au NPs of 13 nm in size. It was found that controlling the metal coordination is the key parameter to template the Au NPs on the spherulite surfaces. The preparation processes and the key factors leading to the formation of PA66 spherulites coated with Au NPs are discussed. Moreover, the efficiency of the coated spherulites as a potential catalyst is proved by demonstrating the reduction of methylene blue via UV-visible spectrometry.     

Group contribution model for determination of molecular diffusivity of non-electrolyte organic compounds in air at ambient conditions

Determination of diffusion coefficients of pure compounds in air is of great interest for modeling of air pollution control processes. In this communication, a Group Contribution (GC) method is applied to represent/predict the molecular diffusivity of chemical compounds in air at 298.15 K and atmospheric pressure. 4661 compounds from various chemical families have been investigated to propose a comprehensive and predictive model. The final model is resulted from coupling the Artificial Neural Network (ANN) with group contributions. Using this dedicated model, we obtain satisfactory results quantified by the following statistical results: Squared Correlation Coefficient=0.995, Standard Deviation Error=0.02, and Average Absolute Deviation=1.4% for the calculated/predicted properties from existing experimental values.     

Emulsion polymerization of styrene: Simulation the effects of mixed ionic and non-ionic surfactant system in the presence of coagulation

A detailed model was developed for emulsion polymerization of styrene in batch reactor to predict the evolution of the product particle size distribution. The effect of binary surfactant systems (ionic/non-ionic surfactants) with different compositions was studied. The zero–one kinetics was employed for the nucleation rate, with the model comprising a set of rigorously developed population balance equations. The modeling incorporated particle formation by both nucleation and coagulation phenomena. The partial differential equations describing the particle population were discretized using finite volume elements. Binary surfactant systems, comprising sodium dodecyl sulfate (SDS) as anionic, and a commercial polyether polyol (Brij35^®) as non-ionic surfactants, were examined with different mass ratios. Increasing non-ionic surfactant mass fraction in binary surfactant system showed the decrease of particle number due to intensifying the coagulation between particles. Broader particle size distributions with greater average particle size were obtained with non-ionic surfactant comparing those obtained with anionic one.     

Single‐wall carbon nanotubes dispersion behavior and its effects on the morphological and mechanical properties of the electrospun nanofibers

The dispersion behavior of single‐walled carbon nanotube (SWCNT) has important effects on morphological and mechanical properties of SWCNT composite nanofibers. The relationship of the dispersion conditions with morphological and mechanical characteristics for SWCNT / polyacrylonitrile (PAN) / polyvinylpyrrolidone (PVP) composite nanofibers have been examined. The SEM and TEM analyses of the nanofibers revealed that the deformation in the nanofiber structures increases with increasing concentration of SWCNTs. Tensile results showed that only 2 wt% SWCNT loading to the electrospun composite nanofibers gave rise to 10‐fold and 3‐fold increase in the tensile modulus and tenacity of nanofiber layers, respectively. Essentially, high mechanical properties and uniform morphology of the composite nanofibers were found at SWCNT concentration of ∼2 wt% due to their stable and individual dispersion. POLYM. COMPOS., 33:1951–1959, 2012. © 2012 Society of Plastics Engineers