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用准相对论Hartree-Fock方法对Nb XIII离子二电子激发组态3d94s2, 3d94s4p, 3d94p2 的能级结构做了全面系统的理论计算研究.在对已有研究结果分析的基础上, 运用最小二乘方法对径向积分参数进行了优化计算, 得到了与这些组态有关的电偶极允许跃迁的谱线波长和跃迁概率.计算结果与最新的实验值做了对比分析, 表明本文计算结果是准确的. 研究发现, 波长40.92 nm的谱线, 属于3d94s(1D)4p2F7/2–3d9 (2D)4s2 2D5/2 的跃迁谱线, 而不属于3d94s (1D)4p4D7/2–3d9(2D)4s2 2D5/2 的跃迁谱线, 即上谱项能级为2F7/2, 而不是4D7/2.
关键词:
Nb XIII离子
二电子激发组态
谱线波长
跃迁概率 相似文献
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应用多组态Dirac-Fock(MCDF)方法,对Xe10+离子进行了理论计算,获得了跃迁波长和概率等数据.通过逐步引入4dn—5pn(n=1, 2, 3)电子相关的相互作用组态,重点研究了电子相关效应对4d8—4d75p跃迁系跃迁概率的影响.结果显示电子相关效应显著,表明了欲得到精确的4d8—4d75p的振子强度(跃迁概率)数据,理论计算中至少要包括到4d2—5p2的电子相关组态的影响.与实验测得的跃迁波长比较发现,理论结果与之有着较好的一致性;同时理论跃迁概率在两种规范下的结果符合得相当精确,显示了计算结果的可靠性.
关键词:
多组态Dirac-Fock(MCDF)方法
电子相关
跃迁概率 相似文献
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用铥空心阴极灯,采用光电流光谱技术测得铥原子21条一级跃迁谱线,确定了相应跃迁上能级的超精细结构常数,其中7个能级的参数为首次发表,运用同一空心阴极灯,采用双色双光子级联共振技术,由荧光法首次测得4个第二激发能级的超精细结构常数. 相似文献
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利用相对论扭曲波方法和新发展的研究电子碰撞激发过程的计算程序REIE06,系统计算了电子碰撞激发高离化态类镍Gd36+和Rn58+—U64+(Z=86—92)离子从基态到4l(l=s,p,d,f)次壳层精细结构能级的碰撞强度和截面.研究了随等电子系列变化时,从基态到与X射线激光有关的3d94p和3d94d激发态能级的电子碰撞激发截面随Z的变化,讨论了强的组态相互作用对高离化态类镍离子截面的影响.通过对Gd36+离子涉及X射线激光跃迁的相关能级电子碰撞激发速率系数的计算,分析了等离子体中电子温度对碰撞过程的影响.同时,目前部分计算结果与以往的理论结果进行了比较,得到了很好的一致性.
关键词:
电子碰撞激发
相对论扭曲波方法
高离化态类镍离子 相似文献
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对SrAl12O19:Pr3+中4f2→4f2电偶极跃迁强度的参量化进行了研究.考虑明确的4f5d组态成分与4f2跃迁能级混杂对4f2组态内跃迁的影响.引入新的强度参数Tkq,参数值由3P0能级的相关实验数据拟合.利用拟合的参数T33和T53计算1S0向下各能级发射的跃迁强度,计算值与实验及Judd-Ofelt理论的结果进行了比较.
关键词:
12O19:Pr3+')" href="#">SrAl12O19:Pr3+
宇称态混杂
4f5d组态
强度参数 相似文献
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用自制钬空心阴极灯,运用光电流光谱技术在569nm~600nm谱区内首次测定了元素钬的9条谱线,确定其相应跃迁能级,及超精细结构常数. 相似文献
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利用软X射线共振非弹性散射谱(resonant inelastic soft X-ray scattering, RIXS)对3d过渡金属硫化物中的硫化锰(MnS)电子结构进行了研究.通过分析Mn2+的2p63d5→2p53d6→2p63d5二次光子过程,得到了共振非弹性散射谱中的两类非弹性峰,d-d电子跃迁和电荷转移(charge-transfer)跃迁.这两部分跃迁分别共振增强于L边附近及伴随峰附近.基于Hartree-Fock方法的多重态计算分别模拟了原子近似下和立方体Oh对称群下共振非弹性散射谱及吸收谱.计算得MnS实际晶体场10Dq值介于0.80eV—0.85eV之间.对MnS和MnO CT跃迁差异的讨论表明MnS较强的CT跃迁来源于其较窄的能隙宽度.
关键词:
软X射线共振非弹性散射
软X射线吸收谱
d-d跃迁
电荷转移 相似文献
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M. Raineri M. Gallardo 《Journal of Quantitative Spectroscopy & Radiative Transfer》2006,102(3):391-395
A capillary light source was used to observe the spectrum of eight times ionized xenon, Xe IX, in the vacuum ultraviolet range, 270-2000 Å. Sixteen transitions have been identified as combinations between energy levels of the 4d96s with 4d95p configuration, and all 4d96s levels have been determined. The present analysis is based on an accurate extrapolation of energy parameters and experimental energy level values in the Pd I isoelectronic sequence. The energy parameters were obtained with Hartree-Fock relativistic calculations. Least-squares parametric calculation has been carried out to study the fit between experimental and theoretical values. 相似文献
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A. V. Loginov 《Optics and Spectroscopy》2003,95(6):869-872
A semiempirical least squares method is used to determine the wave functions for the intermediate coupling between the 4d 95s, 4d 95p, and 4d 95d levels in the XeIX-CeXIII spectra and to calculate the radiative lifetimes of the 4d 95p and 4d 95d levels in these spectra. 相似文献
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The arc spectrum of silver has been remeasured in the range of 1100 to 9800 Å. This yielded some 140 new lines. Analysing these lines together with about 50 previously unidentified lines of Shenstone established 20 new levels. The configurations 4d 9 5s 5p and 4d 9 5s 6s are now completely analysed. In the 4d 9 5s 5d-configuration about half of the expected levels were identified. Two new 4d 9 5s 7s levels were found. 相似文献
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Palladium, silver, and cadmium spectra excited in a low-inductive vacuum spark have been recorded on a vacuum grazing-incidence spectrograph with a grating of 3600 lines/mm and 3 m in radius, in the range 120–350 Å. The 4p 64d-(4p 65p + 4p 64f + 4p 54d 2) transitions in rubidium-like Pd X-Cd XII spectra have been investigated. Twenty two new spectral lines have been identified from the Dirac-Fock and Hartree-Fock calculations and the known lines were measured with high accuracy. The fine-structure intervals for the 4p 64d 2 D ground state and the energies of six, seven, and ten energy levels of excited configurations in Pd X, Ag XI, and Cd XII, respectively, were determined. On the basis of the analysis of isoelectronic regularities in the position of the energy levels, the previous identifications for the In XIII and Sn XIV spectra were refined. 相似文献
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A. V. Loginov 《Optics and Spectroscopy》2018,124(2):151-154
Radiative lifetimes for the 4d94f, 4d95p, 4d95d, and 4d96s levels in the spectra of palladium-like ions Pr XIV and Nd XV are calculated in the electric-dipole approximation by the intermediate coupling semiempirical method with the use of experimental energy levels available in the literature. The radial integrals of transitions necessary for calculating absolute values of transition probabilities are obtained in the length form with Hartree–Fock functions. 相似文献
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The spectrum of Bi VI in a wavelength region of 177–431 Å was studied. The transitions from the levels of the interacting configurations 5d 86s6p+5d 97p+5d 95f+5d 96f to the levels of the 5d 10 and 5d 96s configurations were analyzed. 174 spectral lines were identified, and 79 new levels of high-lying odd configurations of Bi VI were found. 相似文献
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The radiative 4d 105p-4d 95p 2 transitions in the spectra of the In III, Sn IV, Sb V and Te VI, ions, belonging to the silver isoelectronic sequence, have been investigated in the range 250–600 Å with high resolution. The energies of most levels of the 4d 95p 2 configuration with J = 1/2, 3/2, and 5/2, involved in the transitions to the 4d 105p configuration, are found. Along the isoelectronic sequence, the 4d 95p 2 configuration passes from the position below the ionization limit 4d 10 in Te VI to the position above this limit in In III with corresponding autoionization effects. The autoionization widths of levels are measured. The data obtained are compared with the results of calculations by the Hartree-Fock and semiempirical methods. 相似文献
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《Comptes Rendus de l''Academie des Sciences Series IV Physics》2000,1(8):1035-1044
We have demonstrated saturated output on several nickel-like ion X-ray lasers ranging from niobium to silver by using a psec, high-power, chirped-pulse-amplification, tabletop laser. These results have been achieved at wavelengths from 20.3 to 13.9 nm on the Ni-like 3d94d1S0→3d94p1P1 laser line using a total of 5 to 7 J of energy in a traveling wave excitation scheme. Strong amplification is also observed for Ni-like Sn at 11.9 nm. Gain of 41 cm−1, gain-length product of 18, and output energy of 12 μJ are measured for the Ni-like Pd line at 14.7 nm. For Ni-like Mo, experiments are done using multilayer mirrors to obtain two-dimensional images of the output aperture of the laser and to measure the total laser energy as a function of various parameters such as the delay between the short and long pulses and the energy of the two pulses. For Mo we measure an output energy of 2 μJ and a gain-length product of 16.6. To model the Mo experiments, the LASNEX code is used to calculate the hydrodynamic evolution of the plasma and provide the temperatures and densities to the XRASER code, which then does the kinetics calculations to determine the gain. The temporal and spatial evolution of the plasma is studied both with and without radiation transport included for the 4f and 4p→3d Ni-like Mo resonance lines. High gains are predicted and observed for both the 3d94d1S0→3d94p1P1 laser line at 18.9 nm and the 3d94f1P1→3d94d1P1 photopumped line at 22.6 nm. 相似文献