ZnSe：A1深能级的研究

为研究ＺｎＳｅ中的本征缺陷和Ａ１在ＺｎＳｅ中的深能级行为，首先测量了Ｚｎｓｅ单晶体中的深能级，发现只存在Ｅｅ－０．３３ｅＶ一个电子陷阱．然后，通过热扩散的方法，在３００℃～７００℃温度范围内把Ａ１掺杂到ＺｎＳｅ单晶体中，结果发现存在Ｅｅ－０．３３ｅＶ和Ｅｅ－０．７０ｅＶ两个电子陷阱．本文从缺陷化学角度对ＺｎＳｅ中的本征缺陷和Ｅｅ－０．７０ｅＶ深能级的结构及起源进行了讨论．     

用三色三光子电离光谱测量铀原子电离限附近能级

用三台可调谐脉冲染料激光器三步共振电离方法，测量铀原子在电离限附近的能级。测量了在４９７３３－５０２２４ｃｍ＾－１能量区的４０余个能级位置。     

激发态H2(X1∑+g,v=1,J=1)之间的碰撞能量合并

受激拉曼激发H2(0,1)基态的Q支得到H2(1,1)能级.在室温条件下,利用反斯托克斯拉曼散射(CARS)探测技术测量了碰撞能量合并(EP)过程H2(1,1)+H2(1,1)→H2(2,J)+H2(0,J″)及H2(1,1)与H2(1,J)转动能级间的碰撞转移速率系数.扫描CARS谱表明在H2(1,1)能级的碰撞能量...     

ZnSe:A1深能级的研究

为研究ZnSe中的本征缺陷和A1在ZnSe中的深能级行为,首先测量了Znse单晶体中的深能级,发现只存在Ec-0.33eV一个电子陷阱。然后,通过热扩散的方法,在300℃～700℃温度范围内把A1掺杂到ZnSe单晶体中,结果发现存在Ec-0.33eV和Ec-0.70eV两个电子陷阱。本文从缺陷化学角度对ZnSe中的本征缺陷和Ec-0.70eV深能级的结构及起源进行了讨论。     

关于ZnSe—ZnS应变超晶格P型导电机理的探讨

本文利用变温Hall测量,证实了我们用MOCVD法生长的No.87—39A ZnSe-ZnS应变超品格(SLS)具有P型导电特性。文中试图从应变超晶格的临界厚度,电学参数、能带结构等方面解释ZnSe-ZnS SLS反型的原因。文中指出,这时的受主能级可能处于ZnS层靠近界面附近,这些受主能级的位置比ZnSc阱中满带顶能量低。     

用激光共振电离光谱测定铈原子奇宇称高激发态(Ⅰ):32 042～34 575 cm-1

激光共振电离光谱是一种十分适合于高能量区重元素复杂原子结构研究的技术。为寻找原子最佳的共振电离通道，利用这一技术对铈原子奇宇称高激发态进行了研究。在32042－34575cm^-1范围内，用两步共振激发和非共振电离方法，首次观察到了83条铈原子奇宇称高激发态能级，测量了这些新能级的能量和给出了可能的总角动量J值。     

AlyGa1—yAs／AlxGa1—xAs量子阱激光器材料的光致荧光谱

测量了ＡｌｙＧａ１－ｙＡｓ／ＡｌｘＧａ１－ｘ量子阱激光材料的光致荧光谱，发现在室温连续激光器材料的光致荧光谱中有两上峰，而不能激射的材料中则只有一个很宽的峰，将高能峰归属于准费密能级电子的跃迁。     

利用飞行时间法测定锶原子5s5p3P1亚稳态能级寿命

本文结合TOF法和吸收光谱测量技术,利用连续光场测定了锶原子亚稳态能级的寿命。实验中,利用689nm激光连续泵浦基态锶原子至5s5p3P1亚稳态能级,然后在距泵浦区域不同距离处观测处于5s5p3P1态的原子对688nm探测光的吸收强度,得到锶原子5s5p3P1态的能级寿命,我们利用TOF法实验得到的能级寿命为21.9±0.8μs。本文给出的方法具备实验装置简单的优点,同时可获得较高的测量精度。     

V型三能级系统中五阶极化拍频的理论研究

从理论上研究了由于五阶极化强度间的干涉所导致的Ｖ型三能级系统相闰共轭超快调制光谱学，考虑了抽运光束为窄带线宽或宽带线宽的情形。发现能级分裂的测量精度决定于光学跃迁的均匀增宽，即这种技术在测量能级分裂时可得到消除多普勒增宽的精度。     

非破坏性研究半导体材料特性参数

测量了元素和化合物半导体单晶材料的常温、低温下的表面光电压,推导了有关计算公式,计算得出材料的少子扩散长度、深能级和表面能级位置,禁带宽度和化合物组分;由双能级复合理论,研究了少子扩散长度与深能级的关系,计算了深能级浓度和参数;计算结果与其他方法的测量实验值基本一致. 关键词：     

Ab-initio Hartree-Fock self-consistent-field calculations—An indigenous development of computer programs

A set of indigenously developed computer programs for ab-initio Hartree-Fock calculations on both closed- and open-shell molecules have been described. These programs have been written for calculations using GTO basis sets. Integral formulae have been taken from Taketaet al [8]. Structures and functions of the programs have been discussed. These programs have been extensively tested. Molecular integrals over GTO basis sets have been chosen for tests and as numerical examples in this paper. Results of calculations using very accurate minimal bases have been given for methane. Time taken for these computations in a CDC Cyber 180/840 machine has been indicated. Trends in the calculations have also been illustrated by employing 4-gaussian expansions for the STO’s and by varying the basis size for LiH and BH⁺. An erratum to this article is available at .     

IGCC空气侧整体综合优化的研究

主要符号表X。。氮气回注系数如空分整体化系数E。；c燃气轮机压气机效率G。l回注氮气流量万燃气轮机透平前温尼。”系统相对效率G。。煤气氮气掺混流量Ea；，c空气专用压缩机效率N。”系统相对功率1前言整体煤气化联合循环（IGCC）系统模拟与优化逐步受到重视，开展了许多相关研究［‘－‘］。但是，现有的方法［‘，‘］一个突出的问题，它是在设定的具体流程方案下的数值分析，这常常导致落入“局部优化掩盖了整体最优”的误区。本文是研究以空分系统为中心的空气侧子系统的整体优化，阐述基本概念，尝试新方法，并结合大型商业化装…     

Zinc sulfide nanoparticles: Spectral properties and photocatalytic activity in metals reduction reactions

Formation of zinc sulfide nanocrystals in aqueous solutions of various polymers has been studied. Spectral properties of ZnS nanoparticles have been investigated, the structure of the long-wave edge of the fundamental absorption band of ZnS nanocrystals has been analyzed. It has been shown that the variation of the synthesis conditions (stabilizer nature and concentration, solution viscosity, ZnS concentration, etc.) allows tailoring of the ZnS nanocrystals size in the range of 3–10 nm. Photochemical processes in colloidal ZnS solutions, containing zinc chloride and sodium sulfite, have been investigated. It has been found that the irradiation of such solutions results in the reduction of Zn(II), the rate of this reaction growing at a decrease in the size of ZnS nanoparticles. Kinetics of photocatalytic Zn(II) reduction has been studied. It has been concluded that two-electron reduction of adsorbed Zn(II) species is the rate-determining stage of this reaction. Photocatalytic activity of ZnS nanoparticles in KAu(CN)₂ reduction in aqueous solutions has been discovered. Spectral characteristics and kinetics of ZnS/Au⁰ nanocomposite formation have been studied. It has been shown that the photoreduction of gold(I) complex is the equilibrium reaction due to the reverse oxidation of gold nanoparticles by ZnS valence band holes.     

实验室黑白肖像艺术照的拍摄及制作方法的改进

本文对实验室条件下拍摄黑白艺术肖像的方法作了探讨,对放大相片的方法作了改进,给出了实验数据,并对拍摄结果作了分析和讨论。实验获得了放大尺寸的人物肖像艺术照片。     

Poly－3BCMU薄膜光漂白的实验研究

报道了Ｐｏｌｙ－３ＢＣＭＵ薄膜光漂白过程的实验研究结果。测量了薄膜光漂白前后的可见及紫外光谱的变化，表明在光漂白过程中聚合物的长链被逐渐打断。实验表明，被漂白的聚合物薄膜可以被某些有机溶剂溶解，导致所谓的显影过程。实验研究了氧对光漂白过程的影响，并发现在Ｐｏｌｙ－３ＢＣＭＵ薄膜表面涂复光刻胶薄层可阻止氧分子向薄膜内的扩散，从而大大减缓光漂白过程。本文同时对光漂白在制备光波导元件中的应用进行了研究。     

Cinchona alkaloid-based polymer-bound phase-transfer catalysts: Efficient enantioselective alkylation of benzophenone imine of glycine esters

Summary Cross-linked polystyrene-bound and poly(ethylene glycol)-bound phase-transfer catalysts as well as homopolymers of cinchona alkaloid derivatives have been synthesised. Both soluble and insoluble polymers have been investigated. The enantioselective alkylation of N-diphenyl methylene glycine t-butyl ester has been successfully carried out in heterogeneous and homogeneous systems. High enantioselectivities (up to 96%) have been obtained. The polymer-bound catalysts have been easily recovered and conditions for efficient recycling have been studied.     

Modifying a graphene layer by a thymine or a uracil nucleobase: DFT studies

The hybridizations of a graphene layer by a thymine and a uracil nucleobase have been investigated by performing density functional theory (DFT) calculations. The isolated and hybrid structures have been firstly stabilized to reach the minimum energy and the electronic properties have been subsequently evaluated for the optimized structures. The structural and atomic scale parameters indicated that the tip of graphene is important in determining the properties of new hybrids. Moreover, different effects of thymine and uracil nucleobases have been identified in the hybrid structures. Quadrupole coupling constants have been evaluated to characterize the atomic scale properties, in which the most notable effects of hybridizations have been observed for the atoms close to the linking regions whereas negligible effects have been seen for other atoms.     

Photochemical synthesis of ZnO/Ag nanocomposites

Composite ZnO/Ag nanoparticles have been formed via the photocatalytic reduction of silver nitrate over the ZnO nanocrystals, their optical, electrophysical and photochemical properties have been investigated. Mie theory has been applied to analyze the structure of the absorption spectra of ZnO/Ag nanocomposite. The irradiation effects upon the optical properties of ZnO/Ag nanostructure have been investigated. It has been found that the irradiation of ZnO/Ag nanoparticles results in electrons accumulation by both the semiconductor and the metallic components of the nanocomposite. It has been found that silver nitrate can be photochemically deposited onto the surface of ZnO nanoparticles under the illumination with the visible light in the presence of the sensitizer – methylene blue. Kinetics of the sensitized Ag(I) photoredution has been studied. It has been concluded that the key stage of this process is the electron injection from singlet-excited methylene blue molecule into ZnO nanoparticle.     

丝蛋白分子的红外光谱研究

本文记录并研究了桑蚕丝、柞蚕丝、天蚕丝和天柞杂交蚕丝等几类共42种蚕丝样品的红外光谱,确定了柞丝类和桑丝类两大类蚕丝样品在红外光谱方面的差别。从而为鉴别蚕丝样品的种类建立起一种简便易行的方法。通过对各类样品的红外光谱数据处理,计算了某些谱带的相对强度比,获得了一些半定量的规律性结果。     

Studies of phase transitions and ferroelastic domain walls in Pb5Al3F19 crystals by optical measurements

Three phase transitions between 100 and 400 K were previously shown by X-ray diffraction measurements. Such results have been confirmed by optical measurements on crystals. The thermal dependence of the birefringence has been determined. A new phase transformation has been shown at around 590 K not only by optical study but also by dielectric measurements. Ferroelastic domain-walls have been visualized. The sequence transition has been discussed taking into account the various space groups.