宽波段多步激发K_2-系统产生的钾原子高位态辐射

本文首次报道以690.0～715.0nm宽波段范围内任何波长的脉冲染料激光激发K_2—K系统,由高位钾分子与钾原子碰撞以及分子-原子的混合激发等过程而产生钾原子404.4,404.7和470.05～590.0nm波段内高位态辐射的实验结果,并对激发机制进行了探讨.     

Ferrimagnetic coupling in oxamido-bridged Mn(II)Cu(II) compounds: a combined CASPT2 and DDCI study

Multiconfigurational perturbation theory (CASPT2) and difference dedicated configuration interaction (DDCI) are applied to study the ferrimagnetic coupling in an oxamido-bridged Mn(II)Cu(II) molecular species. CASPT2 reproduces the experimental coupling very well. From the partition of the CASPT2 energy, the most important contributions to the coupling are established. Spin populations are calculated with DDCI. The successive improvement of the N-electron wave function allows us to analyse the contributions to the spin delocalization.     

Forward scattering theory of electric-field-gradient-induced birefringence

We attempt to resolve the discrepancy between the Buckingham—Longuet-Higgins (BLH) and Imrie—Raab (IR) theories of linear birefringence induced in a gas of dipolar molecules by an electric field gradient. To this end we present a new calculation of the effect, based on forward scattering of a light beam incident on a thin lamina of gas molecules. We work to electric quadrupole—magnetic dipole order. The beam undergoes a time delay which is proportional to the thickness of the lamina and the electric field gradient, and can therefore be interpreted in terms of a contribution to the refractive index of the gas due to the field gradient. The birefringence is obtained by considering appropriate polarizations of the incident beam. To avoid the occurrence of a divergent quantity, such as appears in the BLH theory, it is essential to take account of the finite beam width. Calculations are performed using both primitive (traced) and traceless molecular quadrupole moments; as required on basic grounds, these results are equivalent. They are also identical to the BLH result. By contrast, the IR result is physically unacceptable because it is not invariant with respect to the use of traced and traceless moments. The source of error in the IR theory remains unclear.     

On the theory of the Buckingham effect

We apply general arguments (based on spatial transformation properties, intrinsic symmetry and dimensional analysis) to the theory of the Buckingham effect (electric-field–gradient-induced birefringence in a gas). These yield, in a simple manner, the temperature-dependent and temperature-independent terms in the birefringence (each to within a numerical factor), and also the expression, derived by Buckingham and Longuet-Higgins, for the effective quadrupole centre of a molecule. We show in addition how the calculation of the two numerical factors can be simplified in our approach.     

蒙药新-Ⅱ中微量硒的测定

采用硒 -硫氰酸钾 -罗丹明 B-明胶 - OP体系分光光度法测定蒙药新 - 中微量硒。其含量为 6 .6—7.3μg· g-1 ,回收率为 94 %— 95 %。     

79Kr高自旋超形变的观测

通过５５Ｍｎ（３０Ｓｉ,αｐｎ）反应布居了７９Ｋｒ的高自旋态．用ＧＡＳＰ阵列配以由４０个ΔＥ×ＥＳｉ（Ａｕ）望远镜所组成的带电粒子球实现γγγ－带电粒子符合测量．观测到由相对强度为（２．７±０．３）％的８条级联γ跃迁所组成的７９Ｋｒ高自旋超形变转动带．除了在转动频率ω＞０．９５ＭｅＶ处急剧下降外,该带的动力学转动惯量近乎常数（22ñ2／ＭｅＶ）并被解释为具有四极形变参数β２＝０．５１以及本征侵入组态为π５０ν５１． High-spinstates in 79Kr were populated via the fusion evaporation reaction 55Mn (30Si,αpn)at 130 MeV.Promptγ γγ charged particle coincidences were measured by using the GASP array in conjunction with the ΔE×E Si(Au) charged particle ball.Asu perdeformed band consisting of 8 γ ray transitions with an intensity of (2.7±0.3)% has been indentified in 79Kr.The dynamic moment of inertia for the band is nearly constant at approxately 22ñ2/MeV below arotational frequency of 0.95 MeV...     

Conformation of N(alpha)-substituted hydrazino acetamides in CDCl3, the precious help of the analysis of Deltadelta between amidic hydrogens, and correlation to the conformation of aza-beta3-peptides

[structures: see text] We studied the conformation of a series of primary amides in a solution of chloroform. Classical NMR tools such as dilution experiments, influence of DMSO, and 2D-NOESY, together with X-ray diffraction, were combined with an analysis of the difference of the chemical shift Deltadelta between the geminal amidic protons. This study was addressed in order to understand the conformation adopted by hydrazino acetamides 1a and 1b as model compounds for aza-beta3-peptides. In this manner, it was possible to show that the amidic group of these compounds acts as a H-bond donor and interacts with two different H-bond acceptors. We concluded that the hydrazinoturn, a specific bifurcated H-bond system observed in the solid state, is also the preferred conformation of hydrazino acetamides 1a and 1b in solution. Our results show that the short-range interaction with the N(alpha)-nitrogen lone pair not only stabilizes the C8 pseudocycle but could also contribute to the folding process of aza-beta3-peptides. In light of this, it could explain why aza-beta3-peptides develop a different H-bond network in comparison to their isosteric beta3-peptides analogues. Our work is in keeping with the recent interest of hydrazino peptides as an extension of the beta-peptide concept.     

Cs–Ba separation using N2O as a reactant gas in a Multiple Collector-Inductively Coupled Plasma Mass Spectrometer collision-reaction cell: Application to the measurements of Cs isotopes in spent nuclear fuel samples

In the general frameworks of the nuclear fuel cycle and environmental research field, the Cs isotopic composition must be known with high precision and accuracy. The direct determination of Cs isotopes by mass spectrometry techniques is generally hampered by the presence of Ba isobaric interferences however. Here we present a new method which takes advantage of the collision-reaction cell based Multiple Collector Inductively Coupled Plasma Mass Spectrometry (MC-ICPMS) and allows to analyse Cs isotopes in the presence of Ba without prior separation step. The addition of N₂O gas in the cell leads to an antagonistic behavior of Cs⁺ and Ba⁺ as the latter reacts with the gas to form BaO⁺ and BaOH⁺ products whereas Cs⁺ remains unreactive. The efficiency of the method was demonstrated for an UOx sample by comparing the results obtained (1) from the measurements of pure Cs fractions and (2) from Fission Products fractions containing more than 30 ionisable elements in addition to Cs, Ba, and where U and Pu were previously removed by using ion exchange resin. An excellent agreement is achieved between each set of experiments with an external reproducibility always better than 0.5% (RSD, k = 2). This study confirms the strong potential of collision–reaction cell to measure Cs isotopes in presence of interfering Ba, precluding therefore former systematic chemical separations.