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91.
Tris‐amidoximate uranyl complexes via η2 binding mode coordinated in aqueous solution shown by X‐ray absorption spectroscopy and density functional theory methods 下载免费PDF全文
Linjuan Zhang Meiying Qie Jing Su Shuo Zhang Jing Zhou Jiong Li Yu Wang Shitong Yang Shuao Wang Jingye Li Guozhong Wu Jian-Qiang Wang 《Journal of synchrotron radiation》2018,25(2):514-522
The present study sheds some light on the long‐standing debate concerning the coordination properties between uranyl ions and the amidoxime ligand, which is a key ingredient for achieving efficient extraction of uranium. Using X‐ray absorption fine structure combined with theoretical simulation methods, the binding mode and bonding nature of a uranyl–amidoxime complex in aqueous solution were determined for the first time. The results show that in a highly concentrated amidoxime solution the preferred binding mode between UO22+ and the amidoxime ligand is η2 coordination with tris‐amidoximate species. In such a uranyl–amidoximate complex with η2 binding motif, strong covalent interaction and orbital hybridization between U 5f/6d and (N, O) 2p should be responsible for the excellent binding ability of the amidoximate ligand to uranyl. The study was performed directly in aqueous solution to avoid the possible binding mode differences caused by crystallization of a single‐crystal sample. This work also is an example of the simultaneous study of local structure and electronic structure in solution systems using combined diagnostic tools. 相似文献
92.
赵艳辉 《浙江大学学报(理学版)》2013,40(4)
利用泛函分析多复变的方法,研究了单位球上βP空间到Za空间的加权Cesàro算子的有界性和紧性问题.获得了单位球上βP空间到Za空间的加权Cesàro算子为有界算子和紧算子的充要条件. 相似文献
93.
The intrinsic localization of electrostatic wave energies in quantum semiconductor plasmas can be described by solitary pulses. The collision properties of these pulses are investigated. In the present study, the fundamental model includes the quantum term, degenerate pressure of the plasma species, and the electron/hole exchange–correlation effects. In cylindrical geometry, using the extended Poincaré–Lighthill–Kuo (PLK) method, the Korteweg–de Vries (KdV) equations and the analytical phase shifts after the collision of two soliton rings are derived. Typical values for GaSb and GaN semiconductors are used to estimate the basic features of soliton rings. It is found that the pulses of GaSb semiconductor carry more energies than the pulses of GaN semiconductor. In addition, the degenerate pressure terms of electrons and holes have strong impact on the phase shift. The present theory may be useful to analyze the collision of localized coherent electrostatic waves in quantum semiconductor plasmas. 相似文献
94.
In this paper,we consider a possible modification of the de Sitter and anti-de Sitter space for the extended uncertainty principle.For the modified anti-de Sitter model we discuss the representation and wave functions of the momentum operator for a one-dimensional box problem.Also,we consider modified Snyder and anti-Snyder models for the generalized uncertainty principle.Then,we assume the Hamiltonian with different potential and solve the Heisenberg algebra for the modified(anti)-de Sitter and(anti)-Snyder models in both position and in the momentum space. 相似文献
95.
Introducing the top partner is a common way to cancel the largest quadratically divergent contribution to the Higgs mass induced by the top quark. In this work, we study single top partner production in the tZ channel at eγ collision in the littlest Higgs model with T-parity(LHT). Since it is well known that polarized beams can enhance the cross section, we analyze the signal via polarized electron beams,and photon beams. we have selected two decay modes for comparison, based on the leptonic or the hadronic decays of the W and Z from the top partner. We then construct a detailed detector simulation, and choose a set of cuts to enhance signal significance. For mode A(B), the capacity for exclusion in this process at s~(1/2)=3TeV is comparable to the current experimental limits with L=1000(500) fb~(-1). If the integrated luminosity can be increased to 3000 fb~(-1), the top partner mass+mTcan be excluded up to 1350(1440) GeV at 2σ level. We also considered the initial state radiation effect, and find that this effect reduces the excluding ability of the eγ collision on the the top partner mass by approximately 10 GeV. Moreover, the ability to exclude the LHT parameter space at eγ collision complements the existing research. 相似文献
96.
广义扩展有限元法及其在裂纹扩展分析中的应用 总被引:1,自引:0,他引:1
结合广义有限元法(GFEM)和扩展有限元法(XFEM)的特点,提出了一种新的数值方法——广义扩展有限元法(GXFEM)。阐述了广义扩展有限元法的基本原理,对相关公式进行推导,探讨数值实施中需注意的重要问题,给出利用广义扩展有限元法进行断裂分析时应力强度因子的计算方法,编写了广义扩展有限元法程序。通过算例进行了应力强度因子的计算,模拟了结构裂纹的扩展过程。算例结果表明,利用广义扩展有限元法计算裂纹扩展问题,不需要进行过密的网格划分,且网格在裂纹扩展后无需重新剖分,具有相当高的计算精度。 相似文献
97.
为了消除非线性因素对相位生成载波解调结果的干扰,降低相位生成载波解调过程中低通滤波器的频响特性对相位生成载波解调结果的影响,该文提出了一种基于扩展卡尔曼滤波椭圆参数估计的相位生成载波微分交叉相乘解调方法。该方法在综合考虑各种非线性因素对相位生成载波微分交叉相乘解调结果的影响的基础上,对传统的相位生成载波微分交叉相乘解调过程进行了改进。经过计算机仿真和实验验证,该文所提出的扩展卡尔曼滤波微分交叉相乘方法能够有效地抑制非线性因素对相位生成载波解调结果的干扰,相比传统的相位生成载波微分交叉相乘方法,其信噪比提高了35.0 d B,总谐波失真降低了30.7 dB,信噪谐波比提高了31.0 dB,且扩展卡尔曼滤波微分交叉相乘方法受解调过程中低通滤波器频响特性的影响较小。 相似文献
98.
HF:H2O2:H2O solution (40%wt.HF: 30wt.%H2O2: H2O, 3:2:1 by volume) was used to reveal extended defects (line, face and volume defects) in bulk ZnTe crystals grown from Te solution. The etch patterns were analyzed based on their size, shape and distribution. The etch figures, both in the shape of pits and hillocks with high resolution, show forms controlled by the symmetries of the respective faces were produced. Two different sizes of pits were observed, the larger‐size pits correspond to dislocations penetrating the surface, however, the smaller‐size texture pits are produced on the defect‐free region, which serve as standard pits on respect faces. The face defects, such as grain boundaries, sub‐grain boundaries, dislocation walls, twins and stacking faults, can be all displayed clearly. Another essential feature of the etchant is that, it can effectively dissolve Te‐rich phase (Te inclusion/precipitates), which makes it promising to reveal the shape of this volume defect. 相似文献
99.
Johanne Heitmann Solheim Boris Zimmermann Valeria Tafintseva Simona Dzurendov Volha Shapaval Achim Kohler 《Molecules (Basel, Switzerland)》2022,27(6)
Extended multiplicative signal correction (EMSC) is a widely used preprocessing technique in infrared spectroscopy. EMSC is a model-based method favored for its flexibility and versatility. The model can be extended by adding constituent spectra to explicitly model-known analytes or interferents. This paper addresses the use of constituent spectra and demonstrates common pitfalls. It clarifies the difference between analyte and interferent spectra, and the importance of orthogonality between model spectra. Different normalization approaches are discussed, and the importance of weighting in the EMSC is demonstrated. The paper illustrates how constituent analyte spectra can be estimated, and how they can be used to extract additional information from spectral features. It is shown that the EMSC parameters can be used in both regression tasks and segmentation tasks. 相似文献
100.
The distinctive features of the atomic and electronic structure of thin surface layers of substances in the process of formation
of epitaxial silicon films on silicon are studied using the procedures of reflection and scattering of ultrasoft x-ray radiation.
The angular distribution of the scattered x-ray radiation (the scattering indicatrices) and the near fine structure of SiL2,3 spectra of reflection are investigated. The assumption of the sensitivity of the observed peak of anomalous scattering (the
Yoneda peak) of x-ray radiation to the presence, in the surface regions of the materials, of extended double-boundary defects,
the defects of packing, grain boundaries, dislocations, etc. is made. It is shown that the experimental procedure used makes
it possible to obtain information on the surface layers of substances.
Translated from Zhurnal Priklaldnoi Spektroskopii, Vol. 67, No. 4, pp. 496–498, July–August, 2000. 相似文献