Absorption and Recurrence Spectra of Li Rydberg Atom in Perpendicular Electric and Magnetic Fields

We develop the semi-closed orbit theory from two degrees of freedom to three non-separable degrees of freedom and put forward a new model potential for the Li Rydberg atom, which reduces the study of the system to an effective one-particle problem. Using this model potential and the closed orbit theory for three degrees of freedom, we calculate the recurrence spectra of Li Rydberg atom in perpendicular electric and magnetic fields. The closed orbits in the corresponding classical system have also been obtained. The Fourier transformed spectra of Li atom have allowed direct comparison between the resonance peaks and the scaled action values of closed orbits, whereas the nonhydrogenic resonance can be explained in terms of the new orbits created by the core scattering. Our result is in good agreement with the quantum spectra, which suggests that our calculation is correct.     

Semiclassical calculation of the recurrence spectra of He Rydberg atom in perpendicular electric and magnetic fields

Closed orbit theory is a semiclassical technique for explaining the spectra of Rydberg atoms in external fields. By developing the closed orbit theory from two degrees of freedom to three non-separable degrees of freedom, we calculated the recurrence spectra of He Rydberg atom in perpendicular electric and magnetic fields. The closed orbits in the corresponding classical system have also been obtained. Fourier transformed spectra of He atoms have allowed direct comparison between the resonance peaks and the scaled action values of closed orbits, whereas the nonhydrogenic resonance can be explained in terms of the new orbits created by the core scattering. The semiclassical result is in good agreement with the quantum spectra, which suggests that our method is correct.     

Recurrence spectra of Li atom in strong external fields

Based upon our previous work [Commun. Theor. Phys.. 40,702 (2003)], we developed the closed orbit theory from two degrees of freedom to three non-separable degrees of freedom and calculated the recurrence spectra of Li Rydberg atom in strong perpendicular electric and magnetic fields. The Fourier transformed spectra of Li atom has allowed direct comparison between the resonance peaks and the scaled action values of closed orbits, whereas the nonhydrogenic resonance can be explained in terms of the new orbits created by the core scattering. The semiclassical result is in good agreement with the quantum one, which suggests that our calculation is correct.     

垂直电磁场中He原子的吸收谱和回归谱的理论计算

半经典闭合轨道理论已经成功地计算了在外加磁场和平行电磁场中的里德堡原子的回归谱.但对于垂直电磁场中的里德堡原子,理论和计算都变得更为复杂.本文把闭合轨道理论推广到三维情况,采用 B.Hüpper的模型势计算了ε=-0.03,主量子数n≈ 40,m=0下He原子在垂直电磁场中的光吸收谱和回归谱,并和H原子在垂直电磁场中的回归谱作比较,突出了实散射的贡献.计算中应用了离子实散射的分区自洽迭代方法,并考虑到轨道的多次重复和离子实的多次散射效应.这是对闭合轨道理论的验证和进一步推广.     

The closed-orbit and the photoabsorption spectra of lithium atom in varying＇magnetic fields

Using a simple analytic formula from closed orbit theory, we have calculated the photoabsorption spectra of Li atom in different magnetic fields. Closed orbits in the corresponding classical system have also been obtained for B=5.96T.We demonstrate schematically that the closed orbits disappear gradually with the decrease of the magnitude of the magnetic field. This gives us a good method to control the closed orbits in the corresponding system by changing the magnetic field, and thus changing the peaks in the photoabaorption spectra. By comparing the photoabsorption spectra of Li atom with those of hydrogen case, we find the core-scattered effects play an important role in multi-electron Rydberg atoms.     

Absorption and Recurrence Spectra of Nonhydrogenic Rydberg Atom Near a Metal Surface

Multielectron to theoretical treatments atoms near a metal surface are essentially more complicated than hydrogen atom with regard By using the semicalssical dosed orbit theory generalized to the multielecton atoms, we study the dynamical properties of the Rydberg lithium atom near a metal surface. The photoabsorption spectra and recurrence spectra of this system have also been calculated. Considering the effect of the ionic core potential of the Rydberg lithium atom, the number of the closed orbits increases, which leads to more peaks in the recurrence spectra than the case of hydrogen atom near a metal surface. This result shows that the core-scattered effects play an important role in nonhydrogenic atoms. This study is a new application of the closed-orbit theory and is of potential experimental interest.     

The closed-orbit and the photoabsorption spectra of the Rydberg hydrogen atom between two parallel metallic surfaces

Using the closed orbit theory, we study the classical motion and calculate the photoabsorption spectra of Rydberg hydrogen atom between two parallel metallic surfaces. The results show that the metallic surfaces have a significant effect on the photoabsorption process. When the distances between the hydrogen atom and the two metallic surfaces are close to a critical value d_c, the number of the closed orbits is the greatest. When the distance larger or smaller than d_c, the number of the closed orbits decreases and the absorption spectra are shown to exhibit a damping oscillation. This work is an interesting new application of closed-orbit theory and is of potential experimental interest.     

Absorption and Recurrence Spectra of Sodium Rydberg Atom in a Strong External Magnetic Field

Using core-scattered closed-orbit theory, we calculate the photoabsorption and the scaled recurrence spectra of sodium Rydberg atom in strong magnetic field below ionization threshold. The non-Coulombic nature of the ionic core have been modified by a model potential, which includes an attractive Coulomb potential and a short-ranged core potential. A family of core-scattered nonhydrogenic closed orbits have also been discovered. The Fourier transformed spectra of sodium atom have allowed direct comparison between peaks in such plot and the scaled action values of closed orbits. The new peaks in the recurrence spectra of sodium atom have been considered as effects caused by the core scattering of returning waves at the ionic core. The results are compared with those of hydrogen case, which show that the core-scattered effects play an important role in alkali-metal atoms.     

Semiclassical calculation of Rydberg He2^＋ molecular of recurrence spectra ion in a magnetic field

Making use of the molecular closed-orbit theory and a new model potential for the Rydberg molecule, we have calculated the recurrence spectra of He^2＋ molecular ion in a magnetic field for different quantum defects. The Fourier transform spectra of He^2＋ molecular ion may be used to perform a direct comparison between peaks in the spectra and the scaled action values of closed orbits of the excited electron in external fields. We find that the spectral modulations can be analysed in terms of the scattering of the excited electron on the molecular core. Unlike the case of the Rydberg atom where the elastic scattering is predominant, modulations produced by inelastic scattering are also vital to the photoabsorption spectrum of the Rydberg molecule. Our results are in good agreement with the quantum results, which suggests that our method is correct.     

电场中里德伯原子动力学性质的半经典理论研究

利用闭合轨道理论和Poincaré截面两种方法研究了鞍点附近电场中高里德伯态Li原子的动力学性质.由于原子实的作用,体系是混沌的,闭合轨道和周期轨道在混沌体系中并存,但二者在Poincaré截面上的反映是不同的.讨论了两种半经典理论在研究混沌体系时的联系,得到了仅靠闭合轨道理论得不到的信息. 关键词： Poincaré截面 回归谱 Stark效应     

Semiclassical Calculation of Recurrence Spectra of He Rydberg Atom in Strong External Fields

Using core-scattered closed-orbit theory and region-splitting iterative method, we calculated the scaled recurrence spectra of helium atom in parallel electric and magnetic fields. Closed orbits in the corresponding classical system have also been obtained. When we search the closed orbits, in order to remove the Coulomb singularity of the classical Hamiltonian motion equations, we implement the Kustaanheimo-Stiefel transformation, which transforms the system from a three-dimensional to a four-dimensional one. The Fourier transformed spectrum of helium atom has allowed direct comparison between peaks in such plot and the scaled action values of closed orbits. The results are compared with those of the hydrogen case, which shows that the core-scattered effects play an important role in the recurrence spectra of the multi-electron Rydberg atom.     

Recurrence Spectra of the Rydberg Hydrogen Atom near Two Parallel Metal Surfaces

Using closed orbit theory, we study the influence of the two parallel metal surfaces on the recurrence spectra of a hydrogen atom placed in the region between the two surfaces. The results show that the metal surfaces have significant effect on the photoabsorption process. Each resonance peak in the recurrence spectra is associated with one electronic closed orbit. In our work, we put the first metal surface at the critical value dc and vary the second metal surface. The results show that when the distances between the hydrogen atom and the two metal surfaces are close to the critical valuedc, the number of the closed orbits is the greatest and there are more peaks in the recurrence spectra. When the distance between the atom and the second metal surface is larger or smaller than dc, the number of the closed orbits decreases and there are fewer peaks in the recurrence spectra. The agreement between the semiclassical calculation spectra and the quantum calculation spectra suggests that our analysis is correct.     

强磁场中Rydberg NO分子的回归谱研究

利用分子的闭合轨道理论和多通道量子亏损理论,考虑核的转动影响,计算了Rydberg NO分子在外磁场中的回归谱.研究表明,复杂谱的结构可以用包含分子实散射的闭合轨道理论来解释,不管是同一通道内的弹性散射还是不同通道间的非弹性散射都起着非常重要的作用,尤其是较大标度作用量下,散射作用远大于基本轨道和重复轨道的贡献,很大程度上影响着体系的动力学性质。     

强场中NO分子回归谱的长程散射矩阵的理论研究

采用半经典散射矩阵方法研究外磁场中高里德伯态双原子分子在能量范围为77010—77050cm^-1的回归谱.通过引进模型势简化强磁场中NO分子的高里德伯电子的势函数,找出其在核转动量子数分别为N=1,3,5的三个通道中的闭合轨道,重点分析了强磁场中NO分子的长程散射矩阵元实部的傅里叶变换谱与闭合轨道之间的一一对应关系.     

Rydberg molecules in external fields: a semiclassical analysis

We analyze the spectra of simple Rydberg molecules in static fields within the framework of closed/periodic-orbit theories. We conclude that in addition to the usual classical orbits one must consider classically forbidden diffractive paths. Further, the molecule brings in a new type of "inelastic" diffractive trajectory in addition to the usual "elastic" diffractive orbits encountered in systems with point scatterers. The relative importance of inelastic versus elastic diffraction is quantified by merging the usual closed orbit theory framework with molecular quantum defect theory.     

里德堡NO分子在强磁场中的回归谱

利用分子轨道理论,结合一个新的模型势,我们给出了里德堡NO分子中激发态电子所受到的作用势的解析表达式.利用分子的闭合轨道理论和分区自洽的迭代方法,首次从理论上计算了NO分子在强磁场中的回归谱.通过和A.Matzkin等人给出的NO分子在强磁场中的实验谱的比较,表明我们的计算是正确的.     

平行电磁场中He+2的回归谱与闭合轨道的研究

利用半经典闭合轨道理论和分区自洽迭代方法计算了Rydberg态下He⁺₂在平行电磁场中的回归谱与闭合轨道. 为了模拟分子实的散射作用,引入一个包含电子交换势的新势能. 利用这一新势能,结合多通道量子亏损和分子闭合轨道理论,讨论了分子实散射效应对平行电磁场中He⁺₂的回归谱与闭合轨道的影响. 关键词： 回归谱 分子半经典闭合轨道 交换势 实散射     

氢分子在磁场中回归谱的散射矩阵理论研究

利用散射矩阵理论,结合扩展的半经典闭合轨道理论和多通道量子亏损理论,计算了磁场中高里德堡H2分子的回归谱.该方法使用了两个空间散射矩阵来描述里德堡电子的动力学性质,计算中可以包括所有阶的实散射的作用.回归谱的每一个尖峰对应着一条闭合轨道,新的额外峰是由于弹性散射和非弹性散射所引起的通道内和通道间的轨道组合,进一步证明了体系通道间和通道内的散射具有同等的重要性.     

On the periodic orbits of perturbed Hooke Hamiltonian systems with three degrees of freedom

We study periodic orbits of Hamiltonian differential systems with three degrees of freedom using the averaging theory. We have chosen the classical integrable Hamiltonian system with the Hooke potential and we study periodic orbits which bifurcate from the periodic orbits of the integrable system perturbed with a non-autonomous potential.