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1.
本文在Koster-Slater格林函数方法和在位(on site)势近似的基础上,提出了一个计算替代杂质对的完整方法,并成功地应用于GaP中O替代杂质对。第一次给出了O-Zn和O-Cd对的波函数。我们发现波函数主要集中在O周围4个格点并指向O的化学键上。然而在这4个键上,波函数的分量并不相等,在O—杂质键上的分量要比其它键上的值小。杂质的排斥势越大,则分量值的不平衡越明显。而波函数的其余部分较为平坦地分布在一相当大的空间内。  相似文献   
2.
利用Koster-Slater的格林函数方法,给出了决定立方半导体中理想双空位在禁带中引入的不同对称态的能级和波函数的完整的方程组。主体半导体的能带结构用一经验的紧束缚哈密顿量来描述,缺陷引入的微扰势则采用在位势近似。在此基本假定下,这些方程组仅涉及到主体半导体的在位(on-site)和离位(off-site)格林函数以及这些格林函数对能量E的微商。 关键词:  相似文献   
3.
利用文献[1]中的基本方程组和Vogl等人的紧束缚哈密顿量,计算了以GaAs,GaP为代表的极性半导体中理想双空位的A_1,E态的波函数。计算表明,理想双空位态的波函数在靠近As空位或P空位处的三个Ga原子处具有最大几率,波函数的其余部分随着离缺陷距离的增加而缓慢非单调地递减。  相似文献   
4.
The thermal ionization energy ET of DX centers in AlxGa1-xAs and its dependence with the value of x and the pressure are very important for estab- lishing the model of DX centers. The conventional DLTS and Hall methods used to DX center measurement have some ambiguities in theoretical analysis and experiments and the values of ET determined are different with those methods. The new constant temperature transient C-V measurement is based on the fact that at low temperature both electron capture and emission rates of DX centers are very slow. During the transient C-V measurement, change; of bias voltages and capacitance measurements are completed in a time duration much shorter than the electron capture and emission time constants, therefore the electrons occupied on the DX centers are considered to be frozen. The density of DX centers, the distribution profile of electrons on DX centers in the depletion region of a Schottky diode at a constant reverse bias, and the density of free electrons in conduction band in the bulk and their temperature dependence have been measured.  相似文献   
5.
胡伟敏  茅德强  任尚元  李名复 《物理学报》1987,36(10):1330-1335
利用文献[1]中的基本方程组和Vogl等人的紧束缚哈密顿量,计算了以GaAs,GaP为代表的极性半导体中理想双空位的A1,E态的波函数。计算表明,理想双空位态的波函数在靠近As空位或P空位处的三个Ga原子处具有最大几率,波函数的其余部分随着离缺陷距离的增加而缓慢非单调地递减。 关键词:  相似文献   
6.
A new electron trap state SD was found by DLTS measurement under light illumination in Si doped A.lxGa1-xAs. This new trap energy level ESD is shallower than the DX center energy in the gap and the concentration of SD is comparable to that of DX centers. The emission activation energy Ec=0.20±0.05eV and capture activation energy Ec= 0.17±0.05eV. The SD DLTS peak has never been detected previously because under dark and thermal equilibrium condition most of the electrons occupy the deeper DX states and most of SD states are empty. However, when the sample is illuminated by light, electrons are excited to the conduction band and then re-captured by SD since the deeper DX states have a slower electron capture rate, thus a new DLTS peak corresponding to SD appears. Constant temperature capacitance transient C-t and transient C-V measurements were also used to further confirm the existence of SD states.  相似文献   
7.
The self-consistent pseudopotential calculation method is used in ab initio calculations of quasiparticle energies for semiconductors with particular attentions paid to GaAs. Although having highly accurate for ground state properties the traditional Density Functional Theory for calculations of many electron systems is not very reliable when applied to excited states. The long standing proble mof underestimations of ab initio calculated energy band gaps for semiconductors and insulators is well known. For Si, Ge and GaAs, e.g., the first principle pssudopotential calculations yield band gaps of 0.52eV, 0.07eV and 0.461eV, respectively, as compared with the experimental measurements of 1.17eV, 0.744eV and 1.51eV. When taking quasiparticle self-energies into account, the excitations (quasiparticle energies) of the many electron systems can be accurately described. The lowest calculated excitation energies above tin highest occupied levels are accurate to within a few percent of experimental band gaps. We have performed ab initio quasiparticle energy calculations for GaAs; our calculated energy band gap Eg= 1.524eV is in excellent agreement with experiments. In Green's function approach GW approximation is utilized, and Generalized Plasma Pole model is used to obtain dynamical dielectric matrix.  相似文献   
8.
A diagram representation method is proposed to interpret the complicated charge pumping(CP) processes. The fast and slow traps in CP measurement are defined.Some phenomena such as CP pulse rise/fall time dependence, frequency dependence,the voltage dependence for the fast and slow traps,and the geometric CP component are clearly illustrated at a glance by the diagram representation.For the slow trap CP measurement,there is a transition stage and a steady stage due to the asymmetry of the electron and hol...  相似文献   
9.
本文指出DX中心电容测量中边区的重要性,提出一种新的瞬态C-V方法,可以用来测量DX中心浓度、导带电子浓度和边区的空间电荷分布及导带电子浓度随温度的变化关系,并由此导出测量DX中心热电离能的方法。另外,还对DX中心正∪和负∪两种模型的理论分析和实验结果进行了比较,得出不同模型所应满足的附加条件。  相似文献   
10.
任尚元  茅德强  李名复 《物理学报》1986,35(11):1457-1464
利用文献[1]中的基本方程和Vogl等人的紧束缚哈密顿量,计算了硅中理想双空位的Eg和Eu态的波函数,讨论了计算结果和ESR与ENDOR谱的比较。 关键词:  相似文献   
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