用椭圆偏振光谱法研究GaxIn1-xP的光学性质(Ⅱ)

用椭偏光谱法对用ＭＯＣＶＤ方法在ＧａＡｓ衬底上生长的ＧａｘＩｎ１－ｘＰ掺Ｓｉ及掺Ｚｎ样品在室温下,可见光区得到的光学常数求其介电函数三级微商谱．将用于分析调制反射谱的三点比例法推广,并用来分析介电函数的三级微商谱．精确地得到样品的带隙Ｅｇ,Ｅｇ＋△０以及Ｅｇ以上成对结构跃迁的能量位置及其间隔．计算了Ｅｇ以及费米能级的相对位置．将实验值与计算值比较,分析其差异的原因,发现样品存在有序结构     

用椭圆偏振光谱法研究GaxIn1—xP的光学性质（Ⅱ）

用椭偏光谱法对用ＭＯＣＶＤ方法在ＧａＡｓ衬底上生长的ＧａｘＩｎ１－ｘＰ掺Ｓｉ及掺Ｚｎ样品在室温下,可见光区得到的光学常数求其介电函数三级微商谱。将用于分析调制反射谱的三点比例法推广,并用来分析介电函数的三级微商谱。精确地得到样品的带隙Ｅｇ,Ｅｇ＋△ｏ以及Ｅｇ以上成对结构跃迁的能量位置及其隔离。计算了Ｅｇ以及费米能级的相对位置。将实验值与计算值比较,分析其差异的原因,发现样品存在有序结构。     

单层二硫化钼光学性质的第一性原理计算

采用基于密度泛函理论的第一性原理方法计算了单层和体材料二硫化钼(MoS2)的电子能带结构及光学性质.在能带结构计算的基础上,计算了单层和体材料MoS2的介电函数虚部及实部,并导出了单层MoS2的能量损失谱、吸收系数、反射率、折射率和消光系数等.同时给出了体材料及单层MoS2介电函数图像中各峰值与对应的能带带间跃迁之间的关系.所得结果与实验结果及现有的理论结果相符合.     

钨酸铅的非德拜型介电谱

在室温至150℃范围测量了纯PWO4晶体和掺镧(La)PWO4晶体的频域介电谱，发现两种样品的介电弛豫都不是德拜型的，晶体中的空位和杂质形成的二和三级结构使得频域介电谱和样品的热力学历史有关。     

基于第一性原理计算压强对CaO电子结构和光学性质的影响

为了探究压强对CaO晶体电子结构和光学性质的影响,采用基于密度泛函理论的第一性原理平面波赝势理论方法对晶体进行了理论计算与分析.优化后所得晶格常数与实验值基本一致.研究结果表明:该晶体属于直接带隙绝缘体,带隙值为4.239 eV,价带顶主要由O-p轨道贡献,导带底由Ca-d轨道贡献.随着压强的增加,介电函数实部和折射率峰值减小,并发生红移,介电函数虚部峰值变大,并发生蓝移,而反射率、吸收系数和能量损失函数的峰值均增大.因此,改变压强可以有效改变CaO的电子结构和光学性质.     

（Pb，Ca）TiO3铁电薄膜光学性质的研究

我们用溶胶凝胶法在Si(100)衬底上制备了(Pb,Ca)TiO3铁电薄膜,测量了其在2．0—5．0eV能量范围的样品的椭偏光谱,并获得在该区间的光学常数谱。实验发现Pb离子被Ca离子取代后,在低能区折射率降低,在高能区折射率增加,并且折射率最大值向低能方向移动;同时随着Ca含量的增加,(Pb,Ca)TiO3的吸收边向低能方向移动,表明Ca离子取代Pb离子后,禁带宽度Eg减小。     

第一性原理研究MoS2的电子结构及光学性质

为了系统深入地研究MoS_2的电子能带结构和光电性质,基于密度泛函理论的第一性原理平面波赝势方法,计算和分析了材料MoS_2的电子结构及其光学性质,给出了MoS_2的能带结构、光吸收谱、电子态密度、能量损失谱、反射谱、介电函数谱等光学性质。计算结果表明:体材料MoS_2的电子跃迁形式是非垂直跃迁,具有间接带隙的半导体材料,带隙宽为1.126 eV;价带和导带的形成是由Mo和S的价电子起作用产生的。通过分析其光学性质,发现MoS_2的介电函数的实部和虚部的峰值都出现在低能区,当光子能量的升高,介电函数值会缓慢降低;材料MoS_2对可见紫外区域的光子具有很强的吸收,最大吸收系数为3.17×105cm~(-1);MoS_2在能量为18.33eV位置出现了共振现象,其它区域内能量的损失值都趋于为0,说明电子之间共振非常微弱。这些光学性质奠定了该材料在制作微电子和光电子器件方面的作用,尤其是在紫外探测器应用方面有着潜在的应用前景,为未来对MoS_2材料的进一步研究提供理论参考。     

Si掺杂InN的电子结构和光学性质的第一性原理计算

采用基于密度泛函理论框架下的第一性原理平面波超软赝势(PWP)方法,结合广义梯度近似(GGA)计算了Si掺杂的InN的电子结构和光学性质,包括能带结构、态密度、介电常数、吸收系数、反射和电子能量损失等.计算表明掺入Si后电子趋于深能级分布,介电函数虚部出现新峰、反射峰的强度有所增强,吸收边和电子能量损失谱有蓝移现象;这些变化与Si掺杂后引起电子密度改变有关.     

层状膜磁光克尔效应的研究及其自动测量仪的建立

以获取磁光材料较全面的介电张量对角元和非对角元复显谱为目的，建立了光学常数谱和磁光常数谱的自动测量系统。阐述了测量系统的理论基础，将测量波长范围拓宽到３２００Ａ至８４００Ａ，能够测量磁光材料的光学常数、磁光克尔旋转角和克尔椭偏率，从而得到材料磁光常数完整的信息。     

用有效介质理论模拟Ag/AAO纳米有序阵列复合结构光学常数

运用Maxwell—Garnett有效介质理论，计算了Ag／阳极氧化铝（AAO）纳米有序阵列复合结构的光学常数（250～2000nm波段），探讨了Ag组分的体积分数对Ag／AAO光学常数的调制作用和Ag纳米粒子的长径比对其表面等离子共振吸收的影响．模拟结果表明，随着Ag组分体积分数的增加，在小于450nm波段，Ag／AAO复合结构的介电函数实部和折射率均逐渐减小，而介电函数虚部和消光系数逐渐增大；在大于450nm波段，Ag／AAO复合结构的介电函数实部、介电函数虚部及折射率均逐渐增大，消光系数则变化较小．模拟结果显示出Ag纳米粒子的长径比与复合结构表面等离子共振吸收峰位有较强的相关性．另外，理论模拟预期透射谱也与实验透射谱变化趋势一致．     

Markedness and its Interpretation in Language Use

Language markedness is a common phenomenon in languages, and is reflected from hearing, vision and sense, i.e. the variation in the three aspects such as phonology, morphology and semantics. This paper focuses on the interpretation of markedness in language use following the three perspectives, i.e. pragmatic interpretation, psychological interpretation and cognitive interpretation, with an aim to define the function of markedness.     

Features of Women's language

Language is a means of verbal communication. People use language to communicate with each other. In the society, no two speakers are exactly alike in the way of speaking. Some differences are due to age, gender, statue and personality. Above all, gender is one of the obvious reasons. The writer of this paper tries to describe the features of women＇s language from these perspectives： pronunciation, intonation, diction, subjects, grammar and discourse. From the discussion of the features of women＇s language, more attention should be paid to language use in social context. What＇s more, the linguistic phenomena in a speaking community can be understood more thoroughly.     

An Analysis of Catherine＇s Character——Wuthering Heights

Wuthering Heights, Emily Bronte＇s only novel, was published in December of 1847 under the pseudonym Ellis Bell. The book did not gain immediate success, but it is now thought one of the finest novels in the English language. Catherine is the key character of this masterpiece, because everybody and everything center on her though she had a short life. We can understand this masterpiece better if we know Catherine well.     

Lower Paleozoic oil relationships within Williston Basin, Canada

The Williston Basin is a significant petroleum province, containing oil production zones that include the Middle Cambrian to Lower Ordovician, Upper Ordovician, Middle Devonian, Upper Devonian and Mississippian and within the Jurassic and Cretaceous. The oils of the Williston Basin exhibit a wide range of geochemical characteristics defined as "oil families", although the geochemical signature of the Cambrian Deadwood Formation and Lower Ordovician Winnipeg reservoired oils does not match any "oil family". Despite their close stratigraphic proximity, it is evident that the oils of the Lower Palaeozoic within the Williston Basin are distinct. This suggests the presence of a new "oil family" within the Williston Basin. Diagnostic geochemical signatures occur in the gasoline range chromatograms, within saturate fraction gas chromatograms and biomarker fingerprints. However, some of the established criteria and cross-plots that are currently used to segregate oils into distinct genetic families within the basin do not always meet with success, particularly when applied to the Lower Palaeozoic oils of the Deadwood and Winnipeg Formation.     

低渗透非均质砂岩油藏启动压力梯度研究

理论推导与室内实验相结合,建立了低渗透非均质砂岩油藏启动压力梯度确定方法。首先借助油藏流场与电场相似的原理,推导了非均质砂岩油藏启动压力梯度计算公式。其次基于稳定流实验方法,建立了非均质砂岩油藏启动压力梯度测试方法。结果表明:低渗透非均质砂岩油藏的启动压力梯度确定遵循两个等效原则。平面非均质油藏的启动压力梯度等于各级渗透率段的启动压力梯度关于长度的加权平均;纵向非均质油藏的启动压力梯度等于各渗透率层的启动压力梯度关于渗透率与渗流面积乘积的加权平均。研究成果可用于有效指导低渗透非均质砂岩油藏的合理井距确定,促进该类油藏的高效开发。     

On Tragic Consciousness In The Works By Ernest Hemingway

As an American modern novelist who were famous in the literary world, Hemingway was not a person who always followed the trend but a sharp observer. At the same time, he was a tragedy maestro, he paid great attention on existence, fate and end-result. The dramatis personae's tragedy of his works was an extreme limit by all means tragedy on the meaning of fearless challenge that failed. The beauty of tragedy was not produced on the destruction of life, but now this kind of value was in the impact activity. They performed for the reader about the tragedy on challenging for the limit and the death.     

Design and analysis of generic LBS application developing platform

Location based services is promising due to its novel working style and contents.A software platform is proposed to provide application programs of typical location based services and support new applications developing efficiently. The analysis shows that this scheme is easy implemented, low cost and adapt to all kinds of mobile nework system.     

Achieving Unusual States of Matter Under High Pressure

正The periodicity of the elements and the non-reactivity of the inner-shell electrons are two related principles of chemistry,rooted in the atomic shell structure.Within compounds,Group I elements,for example,invariably assume the+1 oxidation state,and their chemical properties differ completely from those of the p-block elements.These general rules govern our understanding of chemical structures and reactions.Using first principles calcula-     

Exchange-Correlation and Electronic Excitation Energies from Pairing Matrix Fluctuations

We have developed an adiabatic connection to formulate the ground-state exchange-correlation energy in terms of pairing matrix linear fluctuations.This formulation of the exchange-correlation energy opens a new channel for density functional approximations based on the many-body perturbation theory.We illustrate the potential of such approaches with an approximation based on the particle-particle Random Phase Approximation(pp-RPA).This re-     

Density Functional Theory for the Response of Periodic Systems to Electric Fields Based on the Vector Potential Approach

正The electronic and nuclear(structural/vibrational)response of 1D-3D nanoscale systems to electric fields gives rise to a host of optical,mechanical,spectral,etc.properties that are of high theoretical and applied interest.Due to the computational difficulty of treating such large systems it is convenient to model them as infinite and periodic(at least,in first approximation).The fundamental theoretical/computational problem in doing so is that