Hydrothermal synthesis and electrochemical performance of Fe-doped Co hydroxide electrode materials

Journal of Solid State Electrochemistry - In order to meet the growing energy demand, it is of great significance to develop high-performance electrochemical energy storage materials. In this...     

洗涤用品质量安全检测技术研究进展

洗涤用品是日常使用的产品,其质量安全受到广大消费者的关注。洗涤用品中可能存在的化学风险物质,将对消费者的健康安全产生负面影响。为了减少和避免洗涤用品质量安全问题,研究人员采用多种分析测试技术,开发、建立了洗涤用品中化学风险物质的检测方法。该文综述了近年来洗涤用品质量安全检测技术的研究进展,以期为相关领域的科技人员提供理论支持和技术参考。     

基于氮掺杂活性炭催化氧化合成氮甲基氧化吗啉的研究

以三聚氰胺为氮源,商用活性炭为研究对象,通过“浸渍吸附+高温热处理”的方式制得系列氮掺杂活性炭,并用于催化氧化合成氮甲基氧化吗啉（NMMO）。采用N₂吸附/脱附、Raman、XPS等对氮掺杂活性炭的孔结构和表面性质进行了表征。结果表明：随着三聚氰胺负载量的增大,氮掺杂活性炭的表面碱性含氮官能团含量增大,进而体现出更好的催化氧化合成NMMO活性。最佳催化剂（ACO850-20N）在催化剂加量为0.02 wt%,反应温度70 ℃和反应时间4 h的工艺条件下,氮甲基吗啉的转化率和NMMO收率可达99.76%和94.31%。      

A sensitive and selective HPLC–MS3 method for therapeutic drug monitoring of meropenem and its validation by comparison with HPLC–MS2 methods

Meropenem, a representative β-lactam antibiotic, is widely used to treat complicated and serious infections. Therefore, it is of great significance to monitor the plasma drug concentration for individualized antimicrobial therapy. This study first describes the development and validation of high-performance liquid chromatography–tandem mass spectrometry cubed method for monitoring meropenem in human plasma. Protein precipitation with methanol and a chromatographic analysis time of 7 min make this method simple and of high throughput. Meropenem was extracted from human plasma with recoveries >94.1%. Calibration curves were linear (R² > 0.995) in the concentration range of 0.5–50 μg/mL. Overall accuracy and precision did not exceed 8.0% as well as no significant matrix effect was observed. The novelty of this method is that the triple-stage mass spectrometry technology improves the selectivity and sensitivity. A comparison of the presented method and traditional liquid chromatography–tandem mass spectrometry method was assessed in 44 patients treated with meropenem and Passing–Bablok regression coefficients and Bland–Altman plots showed that no significant difference between the two methods. So the triple-stage mass spectrometry method developed in this study is appropriate and practical for the monitor of meropenem in the daily clinical laboratory practice.     

Kinetics and Mechanism of Catalytic Reduction of U(VI) with Hydrazine on Platinum Catalysts in Nitric Acid Media

The kinetics of U(IV) produced by hydrazine reduction of U(VI) with platinum as a catalyst in nitric acid media was studied to reveal the reaction mechanism and optimize the reaction process. Electron spin resonance (ESR) was used to determine the influence of nitric acid oxidation. The effects of nitric acid, hydrazine, U(VI) concentration, catalyst dosage and temperature on the reaction rate were also studied. In addition, the simulation of the reaction process was performed using density functional theory. The results show that the influence of oxidation on the main reaction is limited when the concentration of nitric acid is below 0.5 mol/L. The reaction kinetics equation below the concentration of 0.5 mol/L is found as: -dc(UO₂²⁺)/dt)=kc^0.5323(UO₂²⁺)c^0.2074(N₂H₅⁺)c^-0.2009(H⁺). When the temperature is 50 ℃, and the solid/liquid ratio r is 0.0667 g/mL, the reaction kinetics constant is k=0.00199 (mol/L)^0.4712/min. Between 20 ℃ and 80 ℃, the reaction rate gradually increases with the increase of temperature, and changes from chemically controlled to diffusion-controlled. The simulations of density functional theory give further insight into the influence of various factors on the reaction process, with which the reaction mechanisms are determined according to the reaction kinetics and the simulation results.     

A Mechanistic Switch in C-H Bond Activation by Elusive Fe\begin{document}$^\text{V}$\end{document}(O)(TAML) Reaction Intermediate: A Theoretical Study

The divergent behavior of C-H bond oxidations of aliphatic substrates compared to those of aromatic substrates shown in Gupta's experiment was mechanistically studied herein by means of density functional theory calculations. Our calculations reveal that such difference is caused by different reaction mechanisms between two kinds of substrates (the aliphatic cyclohexane, 2, 3-dimethylbutane and the aromatic toluene, ethylbenzene and cumene). For the aliphatic substrates, C-H oxidation by the oxidant Fe\begin{document}$^{\rm{V}}$\end{document}(O)(TAML) is a hydrogen atom transfer process; whereas for the aromatic substrates, C-H oxidation is a proton-coupled electron transfer (PCET) process with a proton transfer character on the transition state, that is, a proton-coupled electron transfer process holding a proton transfer-like transition state (PCET(PT)). This difference is caused by the strong \begin{document}$\pi$\end{document}-\begin{document}$\pi$\end{document} interactions between the tetra-anionic TAML ring and the phenyl ring of the aromatic substrates, which has a "pull" effect to make the electron transfer from substrates to the Fe=O moiety inefficient.     

Combination of RSM and NSGA-II algorithm for optimization and prediction of thermal conductivity and viscosity of bioglycol/water mixture containing SiO2 nanoparticles

The fluids containing nanoparticles have enhanced thermo-physical characteristics in comparison with conventional fluids without nanoparticles. Thermal conductivity and viscosity are thermo-physical properties that strongly determine heat transfer and momentum. In this study, the response surface method was firstly used to derive an equation for the thermal conductivity and another one for the viscosity of bioglycol/water mixture (20:80) containing silicon dioxide nanoparticles as a function of temperature as well as the volume fraction of silicon dioxide. Then, NSGA-II algorithm was used for the optimization and maximizing thermal conductivity and minimizing the nanofluid viscosity. Different fronts were implemented and 20th iteration number was selected as Pareto front. The highest thermal conductivity (0.576 W/m.K) and the lowest viscosity (0.61 mPa.s) were obtained at temperature on volume concentration of (80 °C and 2%) and (80 °C without nanoparticle) respectively. It was concluded that the optimum thermal conductivity and viscosity of nanofluid could be obtained at maximum temperature (80 °C) or a temperature close to this temperature. An increase in the volume fraction of silicon dioxide led to the enhancement of thermal conductivity but the solution viscosity was also increased. Therefore, the optimum point should be selected based on the system requirement.     

SO2 Resisting Pd-doped Pr1-xCexMnO3 Perovskites for Efficient Denitration at Low Temperature

H₂-SCR is served as the promising technology for the controlling of NO_x emission, and the Pd-based derivative catalyst exhibited high NO_x reduction performance. Effectively regulating the electronic configuration of the active component is favorable to the rational optimization of noble Pd. In this work, a series of Pr_1-xCe_xMn_1-yPd_yO₃@Ni were successfully synthesized and exhibited superior NO conversion efficiency at low temperatures. 92.7 % conversion efficiency was achieved at 200 °C over Pr_0.9Ce_0.1Mn_0.9Pd_0.1O₃@Ni in the presence of 4 % O₂ with a GHSV of 32000 h⁻¹. Meanwhile, the outstanding performance was obtained in the resistance to SO₂ (200 ppm) and H₂O (8 %). Deduced from the results of XRD, Raman, XPS, and H₂-TPR, the modification of d orbit states in palladium was confirmed originating from the incorporation in the B site of Pr_0.9Ce_0.1Mn_0.9Pd_0.1O₃. The existence of higher valence (Pd³⁺ and Pd⁴⁺) than the bivalence in Pr_0.9Ce_0.1Mn_0.9Pd_0.1O₃ catalyst was evidenced by XPS analysis. Our research provides a new sight into the H₂-SCR through the higher utilization of Pd.     

Effect of thermal annealing on a bilayer polyvinyl alcohol/polyacrylic acid electrospun hydrogel nanofibres loaded with doxorubicin and clarithromycin for a synergism effect against osteosarcoma cells

Polyvinyl alcohol/polyacrylic acid (PVA/PAA) bilayer hydrogel nanofibres were successfully fabricated by electrospinning and physically crosslinked via heat treatment. The effects of the thermal annealing process on the structure, morphology, swelling, thermal properties and hydrophilicity of electrospun nanofibres were investigated. In addition, these membranes were also used to incorporate doxorubicin and clarithromycin for osteosarcoma treatment, one in each layer. These drugs were used because it is hypothesized in this work that a synergism occurs between both drugs. So, these membranes were analyzed towards their dual-drug release and potential cytotoxicity towards the U2OS human osteosarcoma cell line. Moreover, the water contact angle, disintegration, swelling and weight loss studies confirmed the rapid swelling and improved water stability of the annealed PVA/PAA bilayer nanofibres. The annealed bilayer nanofibres exhibited an increase in the average diameter and degree of crystallinity. In addition, the results revealed that a variation occurred in the degree of hydrophilicity of annealed PVA/PAA bilayer nanofibres. The PAA nanofibres surface exhibited higher hydrophilicity than the PVA nanofibres surface. Drug delivery presented to be as fast rate release for clarithromycin and slow-rate release for doxorubicin, which may be advantageous because both drugs exhibited to be synergetic for certain dosages presenting the combination of the drugs higher than 50% of cell inhibition, while these membranes had higher inhibition values (up to 90%), which was attributed to the PAA but also the drugs. These unique properties are of potential interest in drug delivery applications for dual drug delivery where the tunability of surfaces is desirable.