Effect of Different Substrate Temperature on Phosphorus-Doped ZnO Thin Films Prepared by PLD on Sapphire Substrates

Phosphorus-doped ZnO （ZnO：P） thin films are deposited on a c-plane sapphire in oxygen at 350℃, 450℃, 550℃ and 650℃, respectively, by pulsed laser deposition （PLD）, then all the ZnO：P samples are annealed at 650℃ in oxygen with a pressure of 1 × 10^5 Pa. X-ray diffraction measurements indicate that the crystalline quality of the ZnO：P thin films is improved with the increasing substrate temperature from 350℃ to 550℃. With a further increase of the deposition temperature, the crystalline quality of the ZnO：P sample is degraded. The measurements of low-temperature photoluminescence spectra demonstrate that the samples deposited at the substrate temperatures of 350℃ and 450℃ show a strong acceptor-bound exciton （A^0X） emission. The electrical properties of ZnO：P films strongly depend on the deposition temperature. The ZnO：P samples deposited at 350℃ and 450℃ exhibit p-type conductivity. The p-type ZnO：P film deposited at 450℃ shows a resistivity of 1.846Ω·cm and a relatively high hole concentration of 5.100 × 10^17 cm^-3 at room temperature.     

GaAs基GaAsSb/GaInAs双层量子阱的发光

嵌入GaAs中的GaAsSb／GaInAs量子阱因其在1．3～1．5μm光通信波段发光的潜力而受到关注,我们研究了一系列MBE生长的GaAsSb／GaInAs量子阱样品的光致发光,发现所有样品在室温下都出现了一个较强的、波长在1．3μm附近的低能峰和一个较弱的高能峰。变温及变激发功率的荧光谱测量研究发现,高能峰只有在150K以上的测试条件下才能观测到,并且其相对强度随着温度的升高而增加,其调制光谱显示出第一类跃迁的特征。他们建立了理论模型,计算的结果支持将这一发光峰指派为GaInAs层内电子的基态与重空穴激发态间的跃迁,并与实验数据吻合得很好。同时初步讨论了改善1．3μm的低能峰发光的方法。     

掺镨GaN薄膜的微结构与光致发光

利用背散射／沟道（RBS／C）技术、原子力显微镜（AFM）和光致发光（PL）谱研究了掺镨GaN薄膜的微结构和可见光发光特性。RBS／C结果表明,注入Pr后,在注入层引入了晶格损伤;注入样品经1050℃退火后,部分损伤得到恢复,但是晶体质量没有恢复到注入前的状态。AFM结果表明,注入Pr后,表面凹凸不平,而且在注入区引起了膨胀,膨胀幅度达到23．368nm左右。PL结果表明,在850—1050℃退火,发光强度按e指数增加;当退火温度达到1050℃,发光强度最强,经过数据拟合可得Pr^3＋的热激活能为5．8eV。     

不同品种鱼腥草中槲皮素含量的检测与比较

建立鱼腥草中槲皮素的测定方法。90%乙醇为溶剂,索氏提取器提取,HPLC测定槲皮素的含量。Dia-monsilTMC18(4.6mm×150mm,5μm)为色谱柱,流动相为CH3OH-H2O-HAc(48∶49∶3),检测波长为254nm。槲皮素线性范围0.00704—0.06336μg,平均回收率和RSD分别为98.9%和3.2%。方法简便、准确、重现性好,可供鱼腥草原料选择和制剂质量控制的参考。     

叶片弯、掠对压气机端壁流动的影响

通过壁面静压测量、流场显示及气动探针测量研究了不同掠型叶片组成的平面扩压叶栅特性。结果表明,前掠 叶栅流道中横向压力梯度减弱,型面压力沿叶展呈反“C”型,有利于减弱角区低能流体堆积,但中径处损失有所增加; 弯掠叶片强化了上述趋势,其降低端部损失和延缓角区分离的能力更强,应从优化设计角度对其进行深入研究。     

出生缺陷发生率与环境特征异常的相关性研究

我国新生儿高出生缺陷发牛率影响着人口素质,选择了出生缺陷率高的山西省和顺县作为研究地点,从轻重病区分别采集了土壤、水、粮食、头发等作为指标,在实验室中用ICP-电感耦合等离子体发射光谱仪测定了指标中23种元素含量,比较后得出可能与出生缺陷有关的环境元素。结果表明,致病因子可能是以Se为主的复合元素,在和顺县除了低Se外,As,Mg,S,Mo,Ca等元素的小协调叮能起着与低Se复合致病的作用。     

Crystal Structures of Urokinase-type Plasminogen Activator in Complex with 4-（Aminomethyl） Benzoic Acid and 4-（Aminomethyl-phenyl）-methanol

Urokinase-type plasminogen activator （uPA） is a trypsin-like serine protease and plays a key role in several biological processes, including tissue remodeling, cell migration, and matrix degradation. The inhibitors of uPA have been shown to prevent the spread of metastasis and tumor growth, and accordingly uPA is widely recognized as a target for the treatment of cancer. In this work, we report the crystal structures of the complexes of uPA with its inhibitors： 4- （aminomethyl）-benzoic acid （AMBA） and 4-（aminomethyl-phenyl）-methanol （AMPM）, both at a resolution of 2.35 А. The inhibitory constants of these two inhibitors were measured by a chromogenic competitive assay, and it was found that AMBA is a better inhibitor for uPA （Ki = 2.68 mM） than AMPM （Ki = 13.99 mM）. The structural study shows that the binding mode of inhibitor AMBA on uPA is similar to that of AMPM on uPA, both docked into the active site S1 pocket of uPA. Structural details of these complexes are provided to explain the difference of inhibitory constants.     

Synthesis and Crystal Structure of an Ionic Compound [Fe(CN)_6·(PhCH_2NC_9H_7)_4]·12H_2O

A novel ionic compound [Fe(CN)6(PhCH2NC9H7)4]·12H2O (C70H80FeN10O12, Mr = 1309.29) has been synthesized and its structure was characterized by IR, elemental analysis and X-ray diffraction. The compound crystallizes in triclinic, space group P1, with a = 10.968(7), b = 11.466(7), c = 14.077(8) , α = 87.014(7), β = 78.124(7), γ = 72.708(7)o, V = 1654.1(17) 3, Z = 1, Dc = 1.314 g·cm–3, F(000) = 692, μ = 0.298 mm–1, the final R = 0.0519 and wR = 0.1355. The building unit of the title compound consists of four (PhCH2N+C9H7) ions, one [Fe(CN)6]4– anion, and a dozen water molecules. According to the structural analysis, [Fe(CN)6]4– ions are linked together by O–H···O and O–H···N hydrogen bonds, while (PhCH2N+C9H7) and [Fe(CN)6]4– ions interact with each other by electrostatic force to form an ionic compound.     

氢对PbZr0.5Ti0.5O3在氮氢混合气氛退火中铁电性能的影响

采用基于密度泛函理论的第一性原理, 针对PbZr0.5Ti0.5O3无氢和含氢的顺电相和铁电相的二层超晶胞, 分别计算了Ti沿c轴位移时体系总能量的变化、电子云密度分布和Ti—O、Zr—O和H—O的重叠布居数. 结果表明, 含氢铁电相的Ti—O键和Zr—O键相对无氢铁电相明显减弱, 氢氧之间较强的轨道杂化使它们趋于形成共价键; 晶格中氢氧键的钉扎效应使含氢情况下的顺电相能量始终低于铁电相能量, 说明氢的引入阻碍了PbZr0.5Ti0.5O3从立方顺电相到四方铁电相的相变, 并推断其为含氢气氛退火过程中PbZr0.5Ti0.5O3铁电性能下降的主要原因之一. 所得结果对于深入理解铁电材料在氮氢混合气氛退火后铁电性能下降的微观机制具有参考价值.     

星际媒介H2NCH2CN与H2O反应中的H2O分子偶合质子转移机理和氢隧道效应

H2NCH2CN+H2O→H2NCH2C(OH)NH是一个重要的反应, 涉及到星际媒介中甘氨酸的形成, 与早期地球上的氨基酸起源有关. 如果没有考虑氢隧道效应, 在MP2/6-311+G(d,p)级别上计算反应能垒是254.7 kJ·mol-1, 在星际媒介中该气相反应很难进行. 在星际媒介冰颗粒表面上, 水分子催化反应增强了该化学反应的活性. H2NCH2CN与(H2O)3反应中的两个水分子作为催化剂降低活化能77.5 kJ·mol-1和活化自由能70.9 kJ·mol-1, 并且通过氢键桥协同传递质子. 量子氢隧道对于该反应进行至关紧要,采用小弯曲隧道(SCT)近似和正则变分过渡态理论(CVT)方法研究. 温度50 K时, 速率常数kSCT/CVT为1.86×10-23 cm3·molecule-1·s-1, 表明在星际媒介中通过质子隧道机理该反应容易进行. 研究结果与地球上的氨基酸起源于地球本身物质的观点相一致.