Electrochemical Synthesis of Cu (II) Coordination Polymer Coatings Based on 2,2′-Thiodiacetic Acid and 1,2,4,5-Benzenetetracarboxylate

Electrochemical synthesis of coordination polymers of Cu(II), [Cu(TDA)]_n and [Cu₂(BTC)(H₂O)₆?6H₂O]_n in which H₂TDA is 2,2′-thiodiacetic acid and BTC stands for 1,2,4,5-benzenetetracarboxylate was carried out by the electrochemical oxidation of Cu anode in the presence of H₂TDA (a flexible ligand), and 1,2,4,5-benzentetracarboxylic acid (H₄BTC) (a rigid ligand) in aqueous solutions. The structure of coordination polymers were characterized by scanning electron microscopy, X-ray powder diffraction, elemental analysis, thermal gravimetric and differential thermal analyses. The crystal structure of the compounds consists of one-dimensional cubical crystal polymeric units of [Cu(TDA)]_n and [Cu₂(BTC)(H₂O)₆?6H₂O]_n. Furthermore, the coordination number of Cu (II) ions in synthesized coordination polymers to be found five. The main advantages of electrosynthesis are the minor synthesis time, the milder conditions and the facile synthesis of coordination polymer coatings.     

Reducing of heat loss of rubber compound using natural zeolite filler: effect of partially substitution of fillers on compound properties

The main objective of this work was reducing the heat loss of styrene butadiene rubber by partial substitution of carbon black with natural zeolite as a filler. Reducing the usage of carbon black in the rubber industry is a good strategy to decrease fossil fuel usage and global warming. There are different mineral fillers like silica and clay to be used instead of carbon black. Effect of application of natural zeolite on reducing the heat loss of rubber compound based on SBR was investigated by melt mixing of natural zeolite in rubber matrix in an internal mixer. Natural zeolite was selected as 5, 10, 15, and 20 phr. Carbon black was partially substituted with zeolite and the effect of natural zeolite content and structure on different aspects of the compound including heat buildup, hardness, elongation, and modulus were evaluated. It was shown that although cross-link density and mechanical properties of the compounds decreased a little, but a significant improvement was observed in the fatigue resistance of the compounds beside a favorable decrease in the heat buildup and abrasion loss with an increase in the natural zeolite loading. The rate of improvement in properties was slowed down at zeolite contents higher than 5 phr.     

Numerical simulation of transient heat transfer for tomato paste in semi rigid aluminum container

In this study, numerical model of heat transfer for tomato paste in semi-rigid aluminum container was developed by Fluent software 6.3.26. Grid independence was recognized. The impact of head space (air and water -vapor) and buoyancy force on heat transfer were investigated. Simulation results showed slowest heating zone (SHZ) located in (?11.676?<?X?<??10.738, 0.183?<?Y?<?1.269 and 4.417?<?Z?<?5.560) for model with air head space and in (?11.166?<?X?<??11.370, 0.762?<?Y?<?1.21 and 5.480?<?Z?<?5.506) for model with water–vapor head space in Cartesian system coordinate. A thermocouple was connected to container at (0, 0, 10 cartesian system coordinate) to get experimental data during process. Comparing temperatures of experimental model and predicted model (with head space) illustrated no significant difference (p?<?0.05).     

Combining continuous catalytic regenerative naphtha reformer with thermally coupled concept for improving the process yield

Advancements in the catalytic naphtha reforming process, as one of the main processes in petrochemical industry, contributed to development of continuous catalytic regenerative naphtha reformer units. Increasing the yield of aromatic and hydrogen as well as saving the energy in this process through the application of thermal coupling technique is a potentially interesting idea. This novel idea has been assessed in this paper. In the proposed configuration, continuous catalyst regeneration naphtha reforming process is coupled with hydrogenation of nitrobenzene in a two co-axial reactor separated by a solid wall, where the generated heat in nitrobenzene hydrogenation reaction transfers to naphtha reforming reaction medium through the surface of the tube. A steady-state, homogeneous, two-dimensional model is used to describe the performance of this configuration and a kinetic model including 32 pseudo-components with 84 reactions is considered for naphtha reforming reaction. After validating the model with the commercial data of a domestic plant, the obtained results of coupled reactor are compared by the conventional one. The obtained results show the superiority of CCR coupled reactor against the conventional one.     

Mechanistic study of electrochemical oxidation of 4-tert-butylcatechol: A facile electrochemical method for the synthesis of new trimer of 4-tert-butylcatechol

The electrochemical trimerization of 4-tert-butylcatechol via anodic oxidation of 4-tert-butylcatechol (1) is described. The mechanism of trimerization has been studied in aqueous solution using cyclic voltammetry and controlled-potential coulometry. The electrochemical synthesis of trimer 3a has been successfully performed in an undivided cell in good yield and purity.     

4D Printing of Polyvinyl Chloride (PVC): A Detailed Analysis of Microstructure,Programming, and Shape Memory Performance

In this research, polyvinyl chloride (PVC) with excellent shape-memory effects is 4D printed via fused deposition modeling (FDM) technology. An experimental procedure for successful 3D printing of lab-made filament from PVC granules is introduced. Macro- and microstructural features of 3D printed PVC are investigated by means of wide-angle X-ray scattering (WAXS), differential scanning calorimetry (DSC), and dynamic mechanical thermal analysis (DMTA) techniques. A promising shape-memory feature of PVC is hypothesized from the presence of small close imperfect thermodynamically stable crystallites as physical crosslinks, which are further reinforced by mesomorphs and possibly molecular entanglement. A detailed analysis of shape fixity and shape recovery performance of 3D printed PVC is carried out considering three programming scenarios of cold (T_g −45 °C), warm (T_g −15 °C), and hot (T_g +15 °C) and two load holding times of 0 s, and 600 s under three-point bending and compression modes. Extensive insightful discussions are presented, and in conclusion, shape-memory effects are promising,ranging from 83.24% to 100%. Due to the absence of similar results in the specialized literature, this paper is likely to fill a gap in the state-of-the-art shape-memory materials library for 4D printing, and provide pertinent results that are instrumental in the 3D printing of shape-memory PVC-based structures.     

A new hybrid approach to discrete multiple facility location problem

Locating certain facilities in predetermined sites is named the multiple facility location problems (MFLP). The objective of these kinds of problems is locating facilities to serve a given set of customers so that candidate sites and requirements are known. When the new facility sites have to be selected from a given set of candidate sites, the mentioned location problem becomes a discrete multiple facility location problem (DMFLP). In this paper, a special approach of DMFLP is considered where different multiple facilities have to be placed (location decision) and also customers have to be assigned to these facilities (allocation or assignment). The mathematical model of the proposed problem is developed, and with respect to the complexity of solving the mathematical model, especially in large scale, a new hybrid approach is proposed based on tabu search algorithm to solve the problem at each scale. Computational results on several randomly generated problems in comparison with a new proposed lower bound obtained from Lagrangian relaxation indicate that the proposed hybrid approach is both accurate and efficient.     

Ultrathin buffer layer at organic/organic interface for managing the recombination profile in organic light‐emitting diodes: Metal versus dielectric buffer

We report on the utilization of an ultrathin buffer layer at the organic/organic (O/O) interface to enhance device efficiency in organic light‐emitting diodes. Two different kinds of buffer layers are examined: metal and dielectric. It is shown that employment of an ultrathin Ag layer with a thickness of 1–2 nm enhances the device performance, while a MgF₂ dielectric buffer cannot affect the device properties considerably. In particular, the turn‐on voltage of the device with an appropriate buffer layer is reduced about 3 V, its current efficiency increases by a factor of more than three, and the power efficiency increases by a factor of more than five in comparison to the control device when a Ag buffer layer is introduced at the O/O interface. By employment of the buffer layer at the interface, an accumulation of current carriers appears within the device that redistribute the recombination profile toward the interior part of the emissive layer. Also, morphological examinations reveal that distinguishable phase segregation occurs in the blend of the hole‐transport layer. In particular, the polymer component remains at the surface and facilitates the hole transport into the successive layers. © 2016 Wiley Periodicals, Inc. J. Appl. Polym. Sci. 2016 , 133, 43894.     

Assessment of Sustainability in Water Supply-Demand Considering Uncertainties

Water is a vital resource for life on earth; hence its maintenance is very important. Different regions especially in arid and semi-arid areas are facing population growth and subsequent increase in the domestic, industrial and agricultural activities. Planning of water systems in order to be ready for future development conditions needs further studies on the estimation of the sustainable levels of demands based on the sustainable levels of supplies. In this study a threefold approach for estimating sustainability level of supply and demand in Ahachay river basin in northwestern part of Iran as a case study is taken. In the first method, the internal flows and the origins and final uses of the total resources for each subsystem are estimated and planning for sustainability use index is determined by calculating the available water. Second method introduced a simulation model which is utilized to estimate reliability, resiliency, vulnerability and maximum deficit for a river basin to determine a group sustainability index. In the third method, for evaluating the movement toward sustainability, an index is developed. This index includes parameters that are the difference between supply and demand, percentage of the satisfied demand, productivity of water resources and an indicator for evaluating the reduction of aquifer storage. Finally these methods are compared and a hybrid index combining the indices is developed. An uncertainty analysis is also performed to investigate the random nature of variables in estimating water balance and quantifying the water sustainability. This hybrid index can be used for evaluating the planning scenarios and for maintaining and improving the sustainable state of supply-demand for the region.