氮掺杂碳包埋钴纳米粒子电催化合成过氧化氢

电催化还原氧是一种新兴的可持续生产过氧化氢(H2O2)的合成技术,寻找低成本、高活性和高选择性的电催化剂是该技术实际应用的关键.钴氮掺杂的碳材料因含有钴氮(Co-Nx)催化活性位,成为一类新兴的可促进H2O2电化学合成的材料.本文采用低能耗干式球磨外加控制热解的方法来制备包含许多Co-Nx结构的钴氮掺杂碳材料.该方法使用材料廉价,即将醋酸钴、2-甲基咪唑和Ketjenblack EC-600JD高纯度且导电的碳黑分别作为金属、氮和碳的前体.在酸性介质中的电化学测试结果表明,该材料的氧还原反应电流密度明显增加,同时起始电位向正方向移动.该催化剂在较大电位范围内对H2O2的选择性约为90％.H2O2整体电解实验表明,H2O2产率达到100mmol gcat?1 h?1,H2O2法拉第效率达到85％(0.3Vvs.RHE条件下2h).耐久性测试(在0.3Vvs.RHE条件下6h)表明,催化剂表现出相对稳定的性能,且在整个测试循环中,法拉第效率达到约85％,表明催化剂在实际应用中具有良好的耐久性.催化剂表现出较高的电催化合成H2O2活性和选择性可能是由于形成了Co-Nx活性位,以及酸性环境和应用电位等其它因素的影响.     

Hydrothermal synthesis of a mixed-valence hexamolybdate cluster: crystal structure of [HN(CH2CH2)3N]2[HMoVMoVI5O19]·[N(CH2CH2)3N]

The hydrothermal reaction of MoO₃, V, Na₂WO₄· 2H₂O, [N(CH₂CH₂)₃N](1,4-diazabicyclo[2.2.2] octane), and H₂O at 160°C for 90h gave dark-brown crystals of [HN(CH₂CH₂)₃N]₂[HMo^VMo^VI ₅O¹⁹]·[N(CH₂CH₂)₃N], (1), in 40% yield. Complex (1) is the first one-electron reduced mixed-valence hexamolybdate to be crystallized and structurally characterized. The crystal structure of (1) consists of discrete [HMo^VMo^VI ₅O₁₉]^2– anions, [HN-(CH₂CH₂)₃N]⁺ cations, and neutral [N(CH₂CH₂)₃N] molecules of crystallization.     

The chemical constituents of Capparis spinosa of Jordanian origin

Investigation of Capparis spinosa of Jordanian origin lead to isolation of two new compounds beta-sitosterylglucoside-6'-octadecanoate (1) and 3-methyl-2-butenyl-beta-glucoside (2). Linked Scan MS measurements were used to propose a mass fragmentation pattern for the alkaloid Cadabicine isolated here for the second time from nature.     

Familial predictors of childhood shyness: a study of the United Arab Emirates population

OBJECTIVES: Phobic anxiety disorders generally breed true. In this regard, family studies have suggested an association between childhood shyness and maternal social phobia. In this study, the relationship between childhood shyness and maternal social anxiety was examined. SUBJECTS AND METHODS: 203 5-year-old children from an Arabian Gulf community and their mothers were evaluated. The children were assessed in stage 1 using the shyness scale of Stevenson-Hinde and Glover and the Preschool Behavior Checklist (PBCL), while mothers completed the Liebowitz Social Anxiety Scale. In the second stage, blind clinical interviews were carried out to ascertain the diagnosis of psychiatric diagnoses, if any, using DSM-IV criteria. RESULTS: 27% of the children were identified as shy using the shyness scale of Stevenson-Hinde and Glover and 19% scored above the cutoff for behavioral disturbance on the PBCL. Child shyness was associated with female gender and maternal social anxiety as indicated by scores on the Liebowitz Social Anxiety Scale, while an inverse relationship was noted with behavioral disturbance. The odds of the child having a high shyness score was increased if the mother had social anxiety (odds ratio = 2.14) and the child lived in a family that was 'not socially active' (odds ratio = 1.42). CONCLUSION: Our initial findings suggest that there may be a complex interaction between maternal social anxiety and family sociability in childhood shyness. Prospective longitudinal work is indicated.     

ATRP of methyl methacrylate initiated with a bifunctional initiator bearing bromomethyl functional groups: Synthesis of the block and graft copolymers

This article reports the synthesis of the block and graft copolymers using peroxygen‐containing poly(methyl methacrylate) (poly‐MMA) as a macroinitiator that was prepared from the atom transfer radical polymerization (ATRP) of methyl methacrylate (MMA) in the presence of bis(4,4′‐bromomethyl benzoyl peroxide) (BBP). The effects of reaction temperatures on the ATRP system were studied in detail. Kinetic studies were carried out to investigate controlled ATRP for BBP/CuBr/bpy initiating system with MMA at 40 °C and free radical polymerization of styrene (S) at 80 °C. The plots of ln ([M_o]/[M_t]) versus reaction time are linear, corresponding to first‐order kinetics. Poly‐MMA initiators were used in the bulk polymerization of S to obtain poly (MMA‐b‐S) block copolymers. Poly‐MMA initiators containing undecomposed peroygen groups were used for the graft copolymerization of polybutadiene (PBd) and natural rubber (RSS‐3) to obtain crosslinked poly (MMA‐g‐PBd) and poly(MMA‐g‐RSS‐3) graft copolymers. Swelling ratio values (q_v) of the graft copolymers in CHCl₃ were calculated. The characterizations of the polymers were achieved by Fourier‐transform infrared spectroscopy (FTIR), ¹H‐nuclear magnetic resonance (¹H NMR), gel‐permeation chromatography (GPC), differential scanning calorimetry (DSC), thermogravimetric analysis, scanning electron microscopy (SEM), transmission electron microscopy (TEM), atomic force microscopy (AFM), and the fractional precipitation (γ) techniques. © 2010 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 48: 1364–1373, 2010     

Cálculo eficiente de las energías de formación de escalones dobles en materiales BCC

Motion of screw dislocations in BCC materials at low temperature is believed to be related to the formation of mobile kinks on the dislocation line. Therefore, the accurate prediction of kink nucleation energies is required to fully describe mobility of screw dislocations in these materials. Studies of fundamental dislocation processes at atomic length scale are numerically and computationally intensive problems. This work studies the calculation of zero-stress formation energies of kink-pair configurations for BCC crystals. Our model for stored energy associated to a dislocation line configuration is based on the theory of discrete dislocations of Ariza and Ortiz. Its value is computed efficiently using an algorithm developed on the NVIDIA Compute Unified Device Architecture (CUDA). Results confirm those obtained using atomistic potentials and first principles calculations, and those based on the continuum theory of dislocations.     

A new sufficient condition for global robust stability of bidirectional associative memory neural networks with multiple time delays

This paper presents an easily verifiable delay independent sufficient condition for the global robust asymptotic stability of the equilibrium point for bidirectional associative memory (BAM) neural networks with time delays by employing a class of Lyapunov functionals. The obtained results are applicable to all bounded continuous non-monotonic neuron activation functions. Some numerical examples are given to compare our results with the previous robust stability results derived in the literature.     

Description of Even–Even 114–134Xe Isotopes in the Transitional Region of IBM

Properties of ^114–134Xe isotopes are studied in the U(5)?SO(6) transitional region of Interacting Boson Model (IBM-1). The energy levels and B(E2) transition rates are calculated via the affine SU(1,1) Lie Algebra. The agreement with the most recent experimental is acceptable. The evaluated Hamiltonian control parameters suggest a spherical to γ-soft shape transition and propose the ¹³⁰Xe nucleus as the best candidate for the E(5) symmetry.     

Preparation of novel heterogeneous catalysts by adsorption of a cationic tetrapyrrole on to bentonite: equilibrium, kinetics, and thermodynamics

Abstract  

Adsorption of an octacationic tetrapyrrole, octakis(2-trimethylammoniumethylsulfanyl)porphyrazinatocobalt octaiodide (QCoPz), from aqueous solutions on to negatively charged bentonite was investigated. Effects of temperature, dye concentration, solid concentration, and contact time on adsorption were determined. Zeta potential and ion-release measurements were also used as supporting experiments. Experimental data were analyzed using four adsorption kinetic models; a pseudo second-order kinetic model resulted in better correlation with experimental results than the others. Experimental equilibrium data were analyzed by non-linear regression using five adsorption isotherm models with two, three, or four terms. Free energies, enthalpies, and entropies for the adsorption process were determined. The results indicated that adsorption of QCoPz on bentonite was exothermic and spontaneous in nature. FT-IR spectroscopy of the composite and its desorptive behavior were also investigated to identify the mechanism of adsorption. The novel QCoPz–bentonite composites obtained are likely to be used in “green chemistry” and in a wide range of optical and/or catalytic applications, especially those crucially important in the petroleum and pulp/paper industries for waste water cleaning (destruction of mercaptans, sulfides, phenol, and halogenated aromatics, etc.) and removal of bad odor.