碲镉汞材料中Hg空位缺陷的第一性原理研究

利用基于第一性原理的全电子势线性缀加平面波方法计算了在碲镉汞材料中Hg空位所引起的晶格弛豫以及空位对周围原子成键机制的影响.通过成键过程中电荷密度的变化以及电荷转移的讨论，论述了碲镉汞材料Hg空位引起的弛豫以及这种弛豫产生的主要原因.通过态密度的计算和分析，发现Hg空位的形成将导致第一近邻阴离子Te的5s态能量向高能端移动了055eV，并借助Te 5s态电荷密度与成键电荷密度的计算结果，分析了引起该能态能量平移的主要原因.通过带边态密度变化以及Kohn-Sham(KS)单电子能级的计算和分析，得出了Hg 关键词： 碲镉汞 Hg空位 线性缀加平面波方法     

不同变质程度煤的高分辨率透射电镜分析

利用高分辨率透射电子显微镜(HRTEM)分析了三种不同变质程度煤样的结构特征。基于傅里叶-反傅里叶变换方法,并结合Matlab、Arcgis和Auto CAD软件,通过图像分析技术,获得了HRTEM照片的晶格条纹参数。结果表明,三种煤样的晶格条纹呈现不同特征,按条纹长度分别归属于1×1-8×8共计八个类型。以3×3为临界点,在1×1和2×2中,ML-8中芳香层片的比例高于DP-4和XM-3;在3×3-8×8中,ML-8中芳香层片的比例低于DP-4和XM-3。对比HRTEM和XRD参数d002发现,随着镜质组反射率的增加d002都呈现递减趋势。     

不同类型石油卟啉标志物的光谱、质谱及色谱特征

本文利用紫外－可见光谱、质谱及色谱对ETIO、DPEP及Rhodo型石油卟啉标志物的特征性和相关性进行了研究，结果指出，在可见光谱带四个特征峰的吸收强度ETIO型为Ⅳ＞Ⅲ＞Ⅱ＞Ⅰ，DPEP型为Ⅳ＞Ⅱ＞Ⅲ＞ⅠRhodo型为Ⅲ＞Ⅱ＞Ⅳ＞Ⅰ，在反相高效液相色谱的体系中流出顺序为，先流出的是Rhodo型卟啉，其次是ETIO和DPEP型。不同类型卟啉的质谱特征是，各卟啉化合物基本以分子离子峰出现，极少碎片峰，同类卟啉化合物按正态分布。     

激光视网膜凝结机

激光是六十年代兴起的一门新技术.我们成立了研究、生产、使用三结合协作组,制成了激光视网膜凝结机,使这门新技术在眼科治疗中得到了成功的应用. 激光视网膜凝结机可封闭视网膜裂孔,以达到防治视网膜脱离的效果. 视网膜是形成视觉的主要部分.外界景物经过眼睛的角膜、房水、晶状体、玻璃体后,在视网膜上成像.通过视神经传导到大脑,便形成视觉.视网膜具有多层结构,其中在神经上皮层(布满着视细胞)与色素上皮层(含有丰富的黑色素)之间存在着潜在性空隙.在正常情况下,这两层组织靠着玻璃体向外支撑的压力和脉络膜毛细血管的吸引力而保持紧密接…     

微分方程公式的机器推导(Ⅰ)

本文阐述了微分方程公式推导程序系统的算法,这个系统已经实现,并成功地用于极限环的研究工作.作为一个具体例子和验证,文中给出了右方为二次多项式方程的机器结果,并指出了Н.Н.Баутин所发表结果中的符号错误. 本文是微分方程公式推导研究成果的第一部分.     

Tunneling magnetoresistance of the double spin-filter junctions at nonzero bias

A recent theoretical estimation indicated that the NM/FI/FI/NM double spin-filter junction (DSFJ, here the NM and FI represent the nonmagnetic electrode and the ferromagnetic insulator (semiconductor) spacer, respectively) could have very high tunneling magnetoresistance (TMR) at zero bias. To meet the requirement in research and application of the magnetoresistance devices, we have calculated the dependences of tunneling magnetoresistance of DSFJ on the bias (voltage), the thicknesses of ferromagnetic insulators (semiconductors) and the average barrier height. Our results show that except its very high value, the TMR of DSFJ does not decrease monotonously and rapidly with rising bias, but increase slowly at first and decrease then after having reached a maximum value. This feature is in distinct contrast to the ordinary magnetic tunnel junction FM/NI/FM (FM and NI denote the ferromagnetic electrode and the nonmagnetic insulator (semiconductor) spacer, respectively), and is of benefit to the use of DSFJ as a magnetoresistance device.     

Coherent Scattering of Light by Bose-Einstein Condensation in a Tight Confinement

We have observed strong scattering of a probe light by dilute Bose-Einstein condensate （BEC） ^87Rb gas in a tight magnetic trap. The scattering light forms fringes at the image plane. It is found that we can infer the real size of the condensation and the number of the atoms by modelling the imaging system. We present a quantitative calculation of light scattering by the condensed atoms. The calculation shows that the experimental results agree well with the prediction of the generalized diffraction theory, and thus we can directly observe the phase transition of BEC in a tight trap.     

Negative Refraction and Near-Field Imaging of an Elliptical-Rod Photonic Crystal Slab in the Second Band

Negative refraction and imaging properties of the electromagnetic wave through a two-dimensional photonic crystal （PC） slab, which consists of a square lattice of elliptical dielectric rods immersed in the air background, is studied by the plane-wave expansion method and the finite-difference time-domain method. A point source placed in the vicinity of the PC slab can form a good-quality image spot through the PC slab for the incident frequencies within the second photonic band. The calculated result also shows that negative refraction occurs in this kind of PC slab.     

Resonance reaction rate of 21Na(p, γ)22Mg

By using the new Coulomb screening model and most recent experimental results, this paper calculates the resonance reaction rates of ^21Na（p,γ）^22Mg. The derived result shows that the effect of electron screening on resonant reaction is prominent in astrophysical interesting temperature range. In conjunction with the experimental results, the recommended rates of^21Na（p,γ）^22 Mg would increase at least 10%, which undoubtedly affect the nucleosynthesis of some heavier nuclei in a variety of astrophysical sites.[第一段]     

立方非线性Schr?dinger方程的Weierstrass椭圆函数周期解

利用Weierstrass椭圆函数展开法对非线性光学、等离子体物理等许多系统中出现的立方非线性 Schr(o)dinger方程进行了研究.首先通过行波变换将方程化为一个常微分方程,再利用Weierstrass椭圆函数展开法思想将其化为一组超定代数方程组,通过解超定方程组,求得了含Weierstrass椭圆函数的周期解,以及对应的Jacobi椭圆函数解和极限情况下退化的孤波解.该方法有以下两个特点:一是可以借助数学软件Mathematica自动地完成;二是可以用于求解其它的非线性演化方程(方程组).