A relativistic theory of X-ray absorption by spin-polarized targets

We show that, as a consequence of relativistic quantum mechanics, photons with left handed and right handed circular polarizations are absorbed differently by spin-polarized targets. We illustrate this effect by explicit calculation of the K-absorption edge in ferromagnetic Fe.     

X射线吸收谱对Ga0.946Mn0.054As薄膜中缺陷的研究

采用低温分子束外延法(LT-MBE)制备出Ga_0.946Mn_0.054As稀磁半导体(DMS)薄膜.通过X射线吸收谱(XAS)研究影响Ga_0.946Mn_0.054As薄膜性质的主要缺陷Mn间隙原子(Mn_I)和As反位原子(As_Ga).实验结果表明,在较低生长温度(T_S=200℃)下Ga_0.946Mn_{0.054 关键词： 0.946}Mn_0.054As稀磁半导体')" href="#">Ga_0.946Mn_0.054As稀磁半导体 X射线吸收谱 As反位缺陷 Mn间隙原子     

等离子体X射线吸收谱及发射谱研究

 报道计算高温高密等离子体吸收谱和发射谱（光学薄）的理论方法；该方法基于相对论原子理论，可以计算任何单元素以及多元素等离子体的谱分辨X射线吸收谱和发射谱（光学薄）；应用了量子亏损理论，可以减少计算量。利用该方法计算金等离子体LTE吸收谱，计算结果与实验符合良好。本文还对金等离子体LTE的光学薄发射谱进行了研究, 这将有利于对实验进行进一步的诊断分析。该理论计算方法还可提供等离子体内各电离度能级布居等重要物理参数。因此经“标准实验”检验的该理论计算方法将是提供ICF“精密”物理辐射参数的重要基础。     

等离子体X射线吸收谱及发射谱研究

报道计算高温高密等离子体吸收谱和发射谱（光学薄）的理论方法;该方法基于相对论原子理论,可以计算任何单元素以及多元素等离子体的谱分辨X射线吸收谱和发射谱（光学薄）;应用了量子亏损理论,可以减少计算量。利用该方法计算金等离子体LTE吸收谱,计算结果与实验符合良好。本文还对金等离子体LTE的光学薄发射谱进行了研究, 这将有利于对实验进行进一步的诊断分析。该理论计算方法还可提供等离子体内各电离度能级布居等重要物理参数。因此经“标准实验”检验的该理论计算方法将是提供ICF“精密”物理辐射参数的重要基础。     

Excited-state absorption spectra of ZnS : Mn

Absorption bands have been found at 655 and 830 nm in a Mn²⁺-doped ZnS crystal under intense optical excitation. From the close correlation to the orange fluorescence, these bands are ascribed to the transitions from the emitting state ${}^4\text{T}{}_1\text{(}{}^4\text{G)}$ of Mn²⁺. This observation of the excited-state absorption makes it possible for the first time to locate higher excited levels of impurity ions hidden behind the strong fundamental absorption of the host material by a direct optical absorption method. Assignments for the terminal states of the observed absorption transitions are discussed.     

X-ray absorption spectra of cobalt in ferromagnetic borides

The K x-ray absorption spectra of cobalt in the borides, the oxide, and in the pure metal are compared with the magnetic properties. The intensity of the initial absorption region decreases essentially linearly with the transition to higher borides, because of the progressive filling of d-like vacancies in the valence band of the metal by valence sp electrons of boron.Translated from Izvestiya Vysshikh Uchebnykh Zavedenii Fizika, No. 1, pp. 24–28, January, 1970.     

Theoretical interpretation of the vibrational spectra of methyl-substitutedS-triazine

The problems of normal vibrations of mono-, di-, and trimethyl-substituted S-triazine are solved. Assignments of the frequencies of fundamental vibrations for an aromatic ring and methyl groups are suggested. Corrections for methyl substitution for the force constants of S-triazine are determined. The groups of characteristic and noncharacteristic vibrations of the aromatic ring of S-triazine on substitution of hydrogen are established. Saratov State University, 83, Astrakhanskaya St., Saratov, 410601, Russia. Translated from Zhurnal Prikladnoi Spektroskopii, Vol. 65, No. 3, pp. 322–325, May–June, 1998.     

X-ray absorption near edge structure in some Mn compounds

The shapes of the manganese K-absorption edge in the compounds MnSO₄H₂O, MnF₂, MnCO₃, MnO and MnS have been studied using a Cauchois type X-ray spectrograph. Three peaks A, B and C observed in the main edges have been assigned the electronic transitions ls → 3d, ls → 4s and ls → 4p respectively. The transitions have been explained on the basis of the Z + 1 analogy. It has also been shown that the 3d → 4s and 4s → 4p orbital separations depend on the partial charge of an ion in its compound.     

Au激光等离子体X射线发射光谱的理论研究

采用细致组态(detailed configuration accounting,DCA)方法和碰撞辐射模型(collisional radiative equilibriummodel),Cowan的相对论的原子结构理论程序,选取与初、末离子组态有关的平均组态,取Hartree-Fock-Slater自洽势,考虑了非局域热动力学平衡条件下等离子体的主要原子动力学过程,建立了描述等离子体中碰撞辐射模型的离子布居和能级布居的速率方程,得到了Au元素的离子分布和能级分布,电荷态分布和平均电离度,并模拟出Au激光等离子体的5f-3d跃迁的X射线发射光谱的谱线强度,计算得出的谱线强度与实验数据相比符合得较好.     

Local structure of Mn in (Ga,Mn)As probed by X-ray absorption spectroscopy

Local structure of Mn atoms in Ga_1−xMn_xAs epilayers was studied using the X-ray absorption fine structure (XAFS) at Mn K-edge. X-ray near edge structure (XANES) and extended X-ray absorption fine structure (EXAFS) techniques were used. XAFS spectra for different Mn sites has been calculated and compared with the experimental data. Multi-parameter fitting of the EXAFS data indicates that 15-25% of Mn atoms are in interstitial sites in the as grown films. The Mn-As bond length has been found longer than Ga-As bond length in GaAs for both substitutional (Mn_Ga) and interstitial (Mn_I) sites.     

Measurements of X-ray absorption spectra by the prism spectroscopy method

X-ray absorption spectra of a number of samples were measured in the range 5–30 keV by the prism spectrophotometry method. The spectral decomposition was performed using an optically polished diamond prism with an opening angle of 90°. The absorption spectra of liquid bromonaphthalene are presented as an example. An energy resolution of 100–130 eV was achieved in the energy range of ～10 keV, providing the unambiguous identification of elements by jumps in the K photoabsorption.     

Theoretical calculations of atmospheric emission and absorption spectra in the far-infrared

Over the past decade the National Physical Laboratory has been using the method of far-infrared Fourier transform spectroscopy to determine the composition of the upper atmosphere^(1,2) In support of this work we have developed a computer program⁽³⁾ which enables us to calculate theoretical atmospheric spectra using as input data the spectral line positions, strengths and half-widths and appropriate atmospheric profiles of temperature and mixing ratio. This paper presents the results of some recent calculations using this program.     

Theoretical analysis of the spectra of X-ray resonant magnetic reflectivity

We have developed the general computer code for the calculations of reflectivity with polarization analysis from an arbitrary anisotropic multilayer, which allows us to test different approaches for the Bragg reflectivity spectrum treatment. We have proved the validity of the usage of the Bragg peak position for the determination of the energy dependence of the diagonal component of resonant susceptibility tensor, but revealed the essential discrepancy of this procedure for the off-diagonal term determination. The explanation lies in the polarization mixture by multiple reflections at large glancing angles. By the model calculations we have shown that in L-MOKE geometry the observed difference of the integrated Bragg peak reflectivity for the (+) and (−) field direction is predominantly caused by the magnetization of the central part of resonant layer at the first-order Bragg peak, but it is very sensitive to the interface magnetization at the second-order Bragg peak.     

X-ray absorption and emission spectroscopic investigation of Mn doped ZnO films

The electronic structure of (Zn,Mn)O films with different Mn concentrations has been investigated by element-selective soft X-ray absorption and emission spectroscopy. The band gap narrowing of (Zn,Mn)O with increase of Mn concentration (<20% Mn) is attributed to the Mn doping and sp-d exchange interactions. According to analysis of the O Kα and resonant Mn L_2,3 X-ray emission spectra, the splitting of Mn 3d subbands is related to Mn-derived states. It indicates that ferromagnetic coupling in (Zn,Mn)O can be taken into account to be carrier-induced. The presence of antiferromagnetism in the heavier Mn-doped films can be explained in terms of the existence of MnO secondary phases.     

Theoretical explanation of absorption spectra and ESR parameters of Cu in shattuckite

The optical absorption spectra and electronic spin resonance parameters (ESR g factors g_‖, g_⊥ and hyperfine structure constants A_‖, A_⊥) for Cu²⁺ in shattuckite crystal are calculated from the two spin–orbital coupling parameters model, high-order perturbation formulas and complete diagonalization (of energy matrix) method (CDM) of 3d⁹ ion in tetragonal symmetry. The calculated results are in good agreement with the observed values. Since the ESR parameters are sensitive to the local structure of a paramagnetic impurity center, the defect structure of Cu²⁺ center in shattuckite crystal is estimated. The results are discussed.