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1.
In this work, the geometrical structures, the formation energies, and electronic states of the Na(ms)Arn polyatomic exciplexes with m = 3-6 and n = 2-5 are studied by using a quantum-classical method. The interaction potential between an electronically excited sodium atom and argon atoms are calculated by using a one-electron model involving electron-Ar and electron-Na+ pseudopotentials, in which the Hamiltonian is diagonalized at every optimization step in the Basin Hopping algorithm. The relationship between the position of the electronically excited levels and the cluster geometry is investigated as a function of the excitation level and of the spatial extension of the excited electron orbital. We show that the equilibrium structures of the ground state Na(3s)Arn and those of the electronically excited states Na(4s)Arn, Na(5s)Arn, and Na(6s)Arn are significantly different. As a result of the detailed examination of the relationships between the geometrical structure and density distribution of the Na valence electron of the Na∗Arn with n = 2-5 polyatomic exciplexes, we can see that for the Na(4s)Arn polyatomic exciplexes, the two extreme geometries, neutral Na(3s)Arn and ionic Na+Arn compete. It appears that none of them is the actual one. For Na(5s)Arn and Na(6s)Arn the valence electron is very weakly bound to the ionic core and described by a more diffused orbital so that the geometry and the formation energies of this excited state called Rydberg states converge towards those of the ionic cores. 相似文献
2.
最佳跳频序列族的设计与分析 总被引:2,自引:0,他引:2
本文提出了基于p元广义GMW序列和p元Kasami序列构造跳频序列族的方法,证明了基于广义GMW序列所构造的跳频序列族具有最佳Hamming相关特性,而基于Kasami序列所构造的跳频序列族不具有最佳Hamming相关特性。 相似文献
3.
T. Ferrus R. George C.H.W. Barnes N. Lumpkin D.J. Paul M. Pepper 《Physica B: Condensed Matter》2007,400(1-2):218-223
Sodium impurities are diffused electrically to the oxide-semiconductor interface of a silicon MOSFET to create an impurity band. At low temperature and at low electron density, the band is split into an upper and a lower sections under the influence of Coulomb interactions. We used magnetoconductivity measurements to provide evidence for the existence of Hubbard bands and determine the nature of the states in each band. 相似文献
4.
5.
在分析了DDS基本原理以及AD9858基本特点的基础上,介绍了AD9858的送数方式及单片机接口程序。给出了利用AD9858内部寄存器来实现跳频时间小于50ns的4频点快速跳频的具体方法。 相似文献
6.
Ashish K. Verma Jay Tu J. S. Smith Hiroshi Fujioka Eicke R. Weber 《Journal of Electronic Materials》1993,22(12):1417-1420
In this work, we present electrical characterizations of n+ GaAs/low temperature (LT)-Al0.3Ga0.7As/n+ GaAs resistor structures in which the LT layers are grown at nominal substrate temperatures of 250 and 300°C. The resistivity
and Vtfl parameters of these LT-Al0.3Ga0.7As layers are compared with those of LT-GaAs and Al0.3Ga0.7As grown at a normal growth temperature of 720°C. Low-temperature Al0.3Ga0.7As layers exhibit resistivities as high as 1012 ohm-cm, nearly four orders of magnitude higher than that of LT-GaAs, and Vtfl values as high as 45 V, over twice that of LT-GaAs. We also find that the LT-Al0.3Ga0.7As materials grown at 250 and 300°C appear to show opposite and contradictory trends with respect to resistivity and Vtfl. We propose that this result can be explained by residual hopping conduction in the 250°C material. Temperature dependent
conductivity measurements confirm the presence of a hopping mechanism in LT-Al0.3Ga0.7As grown at 250°C and yield activation energies of 0.77 and 0.95 eV for LT-GaAs and LT-Al0.3Ga0.7As, respectively. 相似文献
7.
The observed frequency dependent optical response of hole doped cuprate La1.85Sr0.15CuO4 superconductors, has been theoretically analysed. Starting from an effective two-dimensional (2D) interaction potential for superlattice of hole doped cuprates treated as a layered electron gas, the spectral function is formulated. Calculations of the optical conductivity σ(ω) have been made within the two-component scheme: one is the coherent Drude carriers responsible for superconductivity and the other is incoherent motion of carriers from one site to other leads to a pairing between Drude carriers. The approach accounts for the anomalies reported (frequency dependence of optical conductivity) in the optical measurements for the normal state. Estimating the effective mass from specific heat measurement and ε∞ from band structure calculations for the low-energy charge density waves, the model has only one free parameter, the relaxation rate. The frequency dependent relaxation rates are expressed in terms of memory functions, and the coherent Drude carriers from the effective interaction potential lead to a sharp peak at zero frequency and a long tail at higher frequencies, i.e. in the infrared (IR) region. However, the hopping of carriers from one site to other (incoherent motion of doped carriers) yields a peak value in the optical conductivity centred at mid-IR (MIR) region. We find that both the Drude and hopping carriers in the superlattice of cuprates will contribute to the optical process of conduction in the CuO2 planes and shows similar results on optical conductivity in the MIR as well as IR frequency regions as those revealed from experiments. 相似文献
8.
The charge transport properties of DNA are studied by the first-principle simulation to discuss the possibility of applying DNA to molecular wire. Both the hopping model and band-like model are introduced. By using hopping model, the theoretical hole mobilities calculated by Marcus theory between the same bases in DNA are 5.6 × 10−3, 4.1 × 10−2, 2.0 × 10−2 and 1.2 × 10−4 cm2V−1s−1 for T-T, A-A, C-C and G-G; and the calculated electron mobilities are 5.3 × 10−8, 1.5 × 10−4, 8.1 × 10−7 and 7.5 × 10−10 cm2V−1s−1 for T-T, A-A, C-C and G-G, respectively. And the charge transport for both holes and electrons between different bases exhibits directivity. By using band-like model, we calculated the band width of DNA with double helix structure and bilinear structure to investigate which structure will facilitate to the charge transport. We found that the band width of DNA increased when DNA transforming from the double helix structure to the bilinear structure, which means DNA with the bilinear structure possesses better charge transport properties. This research sheds a light on the molecular design for the molecule serving as the molecular wire. 相似文献
9.
《Physics letters. A》2019,383(17):2090-2092
In this paper, we have used Monte Carlo (MC) method to simulate and study the temperature and doping effects on the electric conductivity of fullerene (C60). The results show that the band gap has reduced by the doping and the charge carrier transport is facilitated from valence band to conduction band by the temperature where is touched a 300 K. In this case, the conductivity reached a value of . The electric conductivity of C60 can increase by the triphenylmethane dye crystal violet (CV) alkali metal to reach at 303 K. Our results of MC simulation have a good agreement with those extracted from literature [10], [33]. 相似文献
10.
K. -M. Haendel U. Denker O. G. Schmidt A. G. M. Jansen R. J. Haug 《Physica E: Low-dimensional Systems and Nanostructures》2004,21(2-4):487
We use magneto-transport spectroscopy to study a dramatic instability between a low and high conductivity mode in Si/SiGe-based resonant tunneling diodes with an embedded layer of self-assembled Ge hut cluster quantum dots in the Si barrier. In the low current regime a simple activation-type behavior with an astonishingly low activation energy in the order of 0.1 meV is determined. In the high current regime a region of negative differential conduction can be observed. We discuss the influence of different layer structures and magnetic fields. 相似文献