Ni/NiO纳米复合材料的制备及其室温下NOx气敏性研究

采用静电纺丝法合成了直径为300 nm Ni(CH3COO) 2/PS纳米纤维,并且通过煅烧得到Ni/NiO纳米复合材料.对Ni/NiO纳米复合材料的NOx气敏性检测研究发现,该材料在室温下对97 ppm NOx有很较好的气敏响应,灵敏度可达到30;以上,响应时间小于4 min.     

Synthesis,Characterization and Application of Organic-inorganic Hybrid and Carbaryl-imprinted Capillary Monolithic Column

Organic-inorganic hybrid and carbaryl-imprinted capillary monolith was synthesized via methacrylic acid（MAA） as functional monomer, γ-methacryloxypropyltrimethoxysilane（γ-MAPS） as crosslinker and carbaryl as template molecule in an acetonitrile/dichloromethane mixture（1：4, volume ratio）. With the capillary column obtained from this monolith, three carbamates（carbaryl, fenobucarb and metolcarb） were separated effectively by electrochromatography with the kMIp/kNlP values of 7.57, 1.27 and 1.64, respectively. In 20 mmol/L phosphate buffer solution（pH=3.5） with 30%（volume fraction） of acetonitrile, carbaryl was separated directly from the three-carbamate mixture（carbaryl, fenobucarb and metolcarb） with an effective 15 cm-length imprinted column.     

Theoretical Study of CH3CH=CH2+O(1D) Reaction: Mechanism and Kinetics

The mechanism and kinetics for the reaction of propene(CH₃CH=CH₂) molecule with O(¹D) atom were investigated theoretically. The electronic structure information of the potential energy surface(PES) was obtained at the B3LYP/6-311+G(d,p) level, and the single-point energies were refined by the multi-level MCG3-MPWB method. The calculated results show that O(¹D) atom can attack CH₃CH=CH₂ via the barrierless insertion mechanism to form four energy-riched intermediates CH₃C(OH)CH₂(IM1), CH₃CHCHOH(IM2), CH₂OHCHCH₂(IM3) and cyclo- CH₂OCHCH₃(IM4), respectively, on the singlet PES. The branching ratios as well as the pressure- and temperaturedependence of various product channels for this multi-well reaction were predicted by variational transition-state and Rice-Ramsperger-Kassel-Marcus(RRKM) theories. The present results will be useful to gain a deep insight into the reaction mechanism and kinetics of CH₃CH=CH₂+O(¹D) reaction.     

Facile Syntheses of 3-Isopentenyl Flavone and 3-Geranyl Flavone

Although there was a strong steric effect, isopentenyl and geranyl moieties were successfully introduced into C3 position in flavone skeleton so as to synthesize the 3-isopentenyl flavone and 3-geranyl flavone under two cyclization conditions(AcOH/HCl and concentrated H₂SO₄/MeOH) in this report. It was found that the optimum cyclization conditions for 3-isopentenyl flavone and 3-geranyl flavone were, respectively, AcOH/HCl and H₂SO₄/MeOH. Furthermore, the donating electron ability is in the sequence 3-geranyl flavone>3-isopentenyl flavone according to the density functional theory(DFT) calculations, suggesting the longer alkyl chain at 3-position would be more favorable for enhancing the donating electron ability. The present synthetic routes might reveal potential applicability in our continued studies on the total syntheses of other natural 3-alkyl flavonoids.     

Characterization of Nanostructures in Acellular Cementum of Human Tooth Roots

Determining the microstructure in human cementum might help us design new kinds of replacement materials for the treatment of teeth injury and disease. The authors characterized the nanostructures in the cementum of health human teeth via scanning electronic microscopy(SEM). It was found that the acellular cementum is mainly composed of two kinds of nanostructures―inorganic nanoparticles and organic nanofibers. And the inorganic nanoparticles show a tendency to arrange along the organic nanofibers. Based on the micro-molding in capillary strategy, the distribution of organic component in acellular cementum was copied with UV curable resin. After removing the inorganic nanoparticles by acid etching, many isolated spindle shape nanopores were left in polymer, which su- ggested that the inorganic nanoparticles should have been isolated by the organic component in cementum, and should be oval or nanosheet in shape. We hope the present work could provide reference for the biomimetic preparation of tissue engineering materials, and help us design new types of tooth implant.     

Temperature Effect on Hydrogen Evolution Reaction at Au Electrode

The temperature dependence of hydrogen evolution reaction (HER) at a quasi-single crys-talline gold electrode in both 0.1 mol/L HClO₄ and 0.1 mol/L KOH solutions was investigated by cyclic voltammetry. HER current displays a clear increase with reaction overpotential (η) and temperature from 278～333 K. In 0.1 mol/L HClO₄ the Tafel slopes are found to increases slightly with temperature from 118 mV/dec to 146 mV/dec, while in 0.1 mol/L KOH it is ca. 153±15 mV/dec without clear temperature-dependent trend. The apparent activation energy (Ea) for HER at equilibrium potential is ca. 48 and 34 kJ/mol in 0.1 mol/L HClO₄ and 0.1 mol/L KOH, respectively. In acid solution, Ea decreases with increase in η, from Ea=37 kJ/mol (η=0.2 V) to 30 kJ/mol (η=0.35 V). In contrast, in 0.1 mol/L KOH, Ea does not show obvious change with η. The pre-exponential factor (A) in 0.1 mol/L HClO₄ is ca. 1 order higher than that in 0.1 mol/L KOH. Toward more negative potential, in 0.1 mol/L HClO₄ A changes little with potential, while in 0.1 mol/L KOH it displays a monotonic increase with η. The change trends of the potential-dependent kinetic parameters for HER at Au electrode in 0.1 mol/L HClO₄ and that in 0.1 mol/L KOH are discussed.     

梅花鹿茸多肽的化学结构及生物活性

在马鹿茸活性多肽结构与功能研究基础上, 从新鲜梅花鹿茸中分离纯化了活性单体多肽, 确定了其化学结构, 并与马鹿茸多肽进行结构与活性比较. 利用离子交换层析、 凝胶过滤层析及反相高效液相色谱层析等生物化学技术, 从梅花鹿茸中分离得到1个新多肽, SDS-PAGE电泳显示为一条带, HPLC图谱为单一峰, MALDI-TOF MS给出该多肽的精确分子量为3263.4, 其等电点pI=8.15. 一级结构研究表明, 该多肽是由32个氨基酸残基组成的直链多肽, 不含半胱氨酸, 富含缬氨酸、 赖氨酸、 亮氨酸和甘氨酸, 氨基酸序列为VLSATDKTNVLAAWGKVGGNAPAFGAEALERM. 生物活性检测结果表明, 该多肽可促进原代培养的表皮细胞和软骨细胞增殖, 也能刺激NIH3T3成纤维细胞株的分裂. 梅花鹿茸多肽与马鹿茸多肽在结构上均为32个氨基酸残基组成的直链多肽, 但第5, 8, 11和30位氨基酸残基不同. 2种多肽结构上的变化并未影响其促细胞增殖生物活性.     

太赫兹量子级联激光器光束特性分析

用有限元法计算太赫兹量子级联激光器激光模式的阈值增益.结果表明:接触层厚度和掺杂浓度对阈值增益的影响远远大于波导宽度和激射波长;接触层厚度较小(大)和掺杂浓度较低(高)时,TM₁(TM₀)模的阈值增益较小.在此基础上,用矢量衍射理论分析岀射光束的远场特性,得到光束的远场光斑基本是椭圆;x方向的远场散射角随波导宽度或激射波长的增加分别线性减小或增加,尽管对应的接触层厚度和掺杂浓度不同,但TM₀和TM₁模x方向的远场散射角相同;另外,还得到y方向远场散射角不受波导宽度或少受激射波长的影响.在阈值增益和光束质量方面,TM₁模都优于TM₀模.     

半晶态聚合物的分子动力学模拟

采用粗粒化聚乙烯醇模型,应用分子动力学方法模拟熔融态聚合物经过缓慢冷却、局部结晶形成半晶态聚合物的过程.静态结构因子的演变显示出在结晶初期小角散射强度的增大先于布拉格峰的出现,这与小角/大角X射线散射实验现象相一致.模拟得到的半晶态聚合物呈现为折叠链构成的晶区与非晶区交杂在一起的结构形态,与缨状微束结构模型相一致.研究发现在不同的冷却阶段具有不同的有序结构形成机制.从结晶温度到玻璃化温度的凝固过程中,存在分子链的伸展和伸直分子链之间平行排列两种形式的结构转变;而在玻璃化温度之后,材料的活性只允许调整伸直分子链之间的相对排列位置.     

一种OFDM系统中叠加导频的信道估计方法

提出了一种新的基于叠加导频的信道估计算法。利用循环序列频域能量集中在某些频点上的特点,消除未知传输数据对导频的影响,将导频完全从接收数据中分离出来。在此基础之上,结合PN序列的自相关特性,在时域进行信道估计,进一步降低了噪声对导频的影响。仿真结果表明,与传统方法相比,该方法不但误码率和均方误差更低,而且还具有计算复杂度低、频带利用率高的特点。