Exergy and exergoeconomic analyses for integration of aromatics separation with aromatics upgrading

Methanol to aromatics produces multiple products, resulting in a limited selectivity of xylene. Aromatics upgrading is an effective way to produce more valuable xylene product, and different feed ratios generate discrepant product distributions. This work integrates the aromatics separation with toluene disproportionation, transalkylation of toluene and trimethylbenzene, and isomerization of xylene and trimethylbenzene. Exergy and exergoeconomic analyses are conducted to give insights in the splitting ratios of benzene, toluene and heavy aromatics for aromatics upgrading. First, a detailed simulation model is developed in Aspen HYSYS. Then, 300 splitting ratio sets of benzene and toluene for conversion are studied to investigate the process performances. The results indicate that there are different preferences for the splitting ratios of benzene and toluene in terms of exergy and exergoeconomic performances. The process generates lower total exergy destruction when the splitting ratio of toluene varies between 0.07 and 0.18, and that of benzene fluctuates between 0.55 and 0.6. Nevertheless, the process presents lower total product unit cost with the splitting ratio of toluene less than 0.18 and that of benzene fluctuating between 0.44 and 0.89. Besides, it is found that distillation is the biggest contributor to the total exergy destruction, accounting for 94.97%.     

Ester-based surfactants: Are they stable enough?

Surfactants with an ester bond connecting the polar headgroup and the hydrophobic tail are common. They are easy to synthesize, they can often be made from natural raw materials and their biodegradation profile is generally good, partly due to lipase or esterase catalyzed breakdown of the ester bond in sewage plants. A labile ester bond in the molecule may cause problems, however. Surfactants are often formulated at relatively high pH and it is important that they remain intact for a given period of time. In this article we discuss alkaline hydrolysis of different types of ester-based surfactants—cationic, anionic and nonionic—and also of surfactant mixtures. We show that the ester bond in a surfactant has a different hydrolysis pattern than ester bonds in non-surface active uncharged molecules. Cationic ester-based surfactants are hydrolyzed rapidly while anionic and also nonionic ester-containing surfactants are relatively resistant to hydrolysis.     

Polydopamine-Assisted Bi-Functional Modification of NiO Anode for Enhanced Lithium-Ion Storage Performance

The blooming requirement of high-performance energy storage systems has aroused the thirst for advanced energy storage materials. As a high capacity anode, however, the application of NiO nanoparticles (NiO NPs) is hindered by intractable issues of dramatic volume change, intrinsic low electronic conductivity, and severe aggregation tendency during lithiation/delithiation. Herein, a polydopamine (PDA) assisted bi-functionalization strategy for fabricating of PDA@NiO-CNT composites for fast and durable lithium storage is reported. In this composite, CNTs intertwine to form a network to ensure sufficient electrolyte infiltration and act as a highly conductive system to motivate fast charge transmission. The strong binding affinity of PDA facilitates bonding between NiO NPs and CNTs, which not only forms uniform and flexible PDA coating but also ensures homogeneous distribution of NiO NPs on CNTs network. Therefore, the bi-functional modified PDA@NiO-CNT electrode possesses high conductivity, alleviates volume change and aggregation of NiO NPs during cycling, achieves a reversible capacity of 1326 mAh g⁻¹ at 100 mA g⁻¹, a rate capability of 215 mAh g⁻¹ at 2000 mA g⁻¹ and a cycling stability with 78% capacity retention after 250 cycles. This bi-functional modification approach manifests its prospective potential for architecting other electrode materials toward high-performance electrochemical devices.     

Simultaneous enhancement of dielectric properties and temperature stability in BaTiO3-based ceramics enabling X8R multilayer ceramic capacitor

Modified BaTiO₃ ceramics that possess high dielectric permittivity and acceptable temperature stability have been widely utilized as multilayer ceramic capacitors (MLCCs) for high-frequency bypass and power filtering in automotive applications. However, since the increasing demand for high-capacity and small-size, high-permittivity materials that can serve as dielectric layers in MLCCs are urgently required. In this work, we design and fabricate a special BaTiO₃-0.03Mg-0.02Y-0.02CaZrO₃ ceramic with a high dielectric permittivity of 3000 and the dielectric variation below ±13% in the temperature range of -55–150°C, fulfilling the requirements of X8R capacitors. To achieve these results, we employed grain size engineering and cation doping, using BaTiO₃ precursors with a particle size of 240 nm to prepare the BaTiO₃-based ceramics with fine grains, while Mg and Y co-doping was used for improving the temperature stability due to dielectric dispersion. Utilizing these high-permittivity BaTiO₃-based materials, we fabricated MLCCs that satisfy the X8R criterion, possessing a high dielectric constant of 2950 and a high breakdown field (410 kV/cm).     

Horseradish peroxidase-mediated polyethylene glycol-templated polymerisation of gallic acid and pyrrole to improve the functionalisation and dyeing properties of silk fabrics

Silk fabrics treated with gallic acid/pyrrole (PGA/PPy) complexes polymerised using horseradish peroxidase have higher electrochemical activity than silk fabrics dyed with gallic acid alone. However, the degree of polymerisation decreases. As a result, the ultraviolet (UV) protection and fastness of the silk fabric were lowered. To solve this problem, we studied the degree of polymerisation of the complex and the functionality of dyed silk fabrics by applying a polyethylene glycol (PEG) template to the enzymatic polymerisation of PGA/PPy. The polymerisation mechanism of the complexes was analysed in detail using UV-visible spectroscopy, Fourier-transform infrared (FTIR) spectroscopy, and high-performance liquid chromatography electrospray ionisation mass spectrometry (HPLC-ESI-MS). Consequently, the PGA/PPy/PEG complex has a higher degree of polymerisation than the PGA/PPy prepared without PEG, indicating that the PEG template can promote the polymerisation of PGA and PPy. As a result, we found that the presence of the PEG template improved the thermal stability and UV protection function of the dyed silk fabric, but did not impair the electrochemical activity of silk fabric. As a result of analysing the colour depth, it exhibited a higher K/S value compared to the dyed silk fabric in the absence of PEG. Additionally, its colour fastness was improved.     

The chemical process monitoring method based on temporal extended orthogonal neighbourhood preserving embedding (TONPE)

Due to the high dimensionality, non-linearity and dynamic characteristics of chemical process data, a fault monitoring method based on temporal extension orthogonal neighbourhood preserving embedding (TONPE) is proposed. In order to make up for the shortcomings of the orthogonal neighbourhood preserving embedding (ONPE) algorithm, an information extraction strategy based on spatio-temporal structure is developed. First, a local neighbourhood set with spatio-temporal characteristics is established, and a weight matrix with spatio-temporal is reconstructed for each time point through the nearest neighbour in space and time. Then, a projection matrix with orthogonal constraints is obtained to establish a monitoring model. The TONPE algorithm can fully capture the local dynamic changes of high-dimensional data by extracting two different manifold features, so that the low-dimensional space has better performance capabilities. The simulation results of the continuous stirred tank reactor process and the Tennessee Eastman process verify the effectiveness of the TONPE algorithm in chemical process monitoring.     

Metallurgical solid waste modified thermoplastic polyurethane composites: The thermal stability and combustion properties

As a kind of bulk industrial solid waste, the massive accumulation of iron tailings has caused serious waste of resources and environmental pollution. In this study, a silane coupling agent (KH550) was used to modify the surface of iron tailings to produce MIT, and it was compounded with ammonium polyphosphate (APP) on thermoplastic polyurethane (TPU) to prepare a series of TPU/APP/MIT composites. Thermogravimetric (TG), cone calorimetric (CCT), thermogravimetric infrared, scanning electron microscopy, and Raman techniques were also used to analyze the combustion performance, smoke toxicity, and microscopic morphology. The TG test results showed that the compounding of APP and MIT significantly improved the residual carbon value of TPU composites at 700°C. CCT test results showed that the TPU/APP/MIT composites exhibited excellent flame retardancy and smoke suppression. Compared with pure TPU, PHRR, THR, and TSR of TPU/APP15/MIT10 composite decreased by 85.56%, 87.83%, and 86.17%, respectively, the peak release rates of CO and CO₂ decreased by 69.26% and 90.34%, respectively. The above studies showed that APP and MIT have excellent flame retardant and smoke suppression effect on TPU materials, providing more opportunities for the study of TPU composites and metallurgical solid waste utilization.     

Comparitive study on facilitated pertraction of succinic acid using TRI‐n‐octylamine without and with 1‐octanol

Succinic acid has been pertracted with TOA using free liquid membranes without or with 1‐octanol. The addition of the alcohol led to the increase of up to 2.8–3 times of the acid's initial and final mass flows. At the same time, the influence of 1‐octanol on the transport capacity of the pertraction system was negative, its addition inducing the accumulation of succinic acid into the liquid membrane. A mathematical model describing the acid accumulation inside the liquid membrane has been developed for pertraction systems without and with 1‐octanol and offers good concordance with the experimental data. © 2012 Canadian Society for Chemical Engineering     

Synthesis and Biological Evaluation of N‐Substituted Sophocarpinic Acid Derivatives as Coxsackievirus B3 Inhibitors

A series of novel N‐substituted sophocarpinic acid derivatives was designed, synthesized, and evaluated for their anti‐enteroviral activities against coxsackievirus type B3 (CVB3) and coxsackievirus type B6 (CVB6) in Vero cells. Structure–activity relationship analysis revealed that the introduction of a benzenesulfonyl moiety on the 12‐nitrogen atom in (E)‐β,γ‐sophocarpinic acid might significantly enhance anti‐CVB3 activity. Among the derivatives, (E)‐12‐N‐(m‐cyanobenzenesulfonyl)‐β,γ‐sophocarpinic acid ( 11 m ), possessing a meta‐cyanobenzenesulfonyl group, exhibited potent activity against CVB3 with a selectivity index (SI) of 107. Furthermore, compound 11 m also showed a good oral pharmacokinetic profile, with an AUC value of 7.29 μM h^?1 in rats, and good safety through the oral route in mice, with an LD₅₀ value of >1000 mg kg^?1; these values suggest a druggable characteristic. Therefore, compound 11 m was selected for further investigation as a promising CVB3 inhibitor. We consider (E)‐β,γ‐N‐(benzenesulfonyl)sophocarpinic acids to be a novel class of anti‐CVB3 agents.     

Characterization and anticorrosive properties of poly(2,3‐dimethylaniline)/Na+‐montmorillonite composite prepared by emulsion polymerization

Composites of Poly(2,3‐dimethylaniline) and inorganic Na⁺‐montmorillonite clay were synthesized by emulsion polymerization. The as‐synthesized composites (PDMA) were characterized by Fourier Transform Infrared Spectroscopy, X‐ray diffraction, and scanning electron microscopy. The protective performance against corrosion of the samples was evaluated by Tafel and electrochemical impedance spectroscopy measurements. The results showed that the composite containing 5 wt. % of clay loading (PDMA‐5%) displayed a better anticorrosive performance than other samples. The Epoxy(E) blend with PDMA‐5% (EPM5) coating was founded to have a higher corrosion potential and a lower current density than that of Epoxy blend P(2,3‐DMA) (EP) coating. The impedance value of EPM5 coating was about 6.68×10⁶Ω·cm² in 5 wt. % NaCl solution even after 288 h, compared to EP (4.26×10⁵Ω·cm²) coating, which went to show that the corrosion inhibition of P(2,3‐DMA) could be effectively enhanced by incorporating MMT into the P(2,3‐DMA) matrix. © 2013 Wiley Periodicals, Inc. J. Appl. Polym. Sci. 130: 4528–4533, 2013