is an extension of this work. Dehof et al. used the same penalty scores as Wang et al., and developed three exact solvers guaranteed to find a bond order assignment with minimum total penalty score, as well as allowing enumeration of all possible bond order assignments with minimum total ...
All currency hedged share classes of this fund use derivatives to hedge currency risk. The use of derivatives for a share class could pose a potential risk of contagion (also known as spill-over) to other share classes in the fund. The fund’s management company will ensure appropriate proced...
Since electron density and other attributes are defined by the fewest number of filled orbitals in the fastest-convergent manner, all these localized basis sets are complete and define the wavefunctions in the most practical manner. The second-order perturbation interaction energy (E(2)), which is...
and the Investment Adviser has full discretion to select the fund’s investments. The binding elements of the investment strategy are as follows: (1) Maintain that the Fund holds at least 20% in Sustainable Investments. In relation to such Sustainable Investments, at least 1% of the Fund’s ...
Basis set superposition errors (BSSE) are very relevant in describing the relative order of stability of the oxide of trimethyl derivatives of group 15 elements . Explicit scalar relativistic (s.r.) ZORA (zero-order regular approximation) corrections are essential to reproduce correctly geometrical ...
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The crystal structures of all of them were determined by X-ray diffraction analysis.DOI: 10.1021/om060060z 被引量: 1 年份: 2006 收藏 引用 批量引用 报错 分享 全部来源 求助全文 dx.doi.org 相似文献 参考文献 引证文献Intermolecular Amidation of Unactivated sp2 and sp3 C−H Bonds via ...
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K-edge XAS directly probes the covalent interactions of individual elements in a molecular system by selectively exciting the core 1s electrons with high-energy X-rays. This technique made it possible for us to isolate and selectively excite transitions in theDye-X•+···Cl–dimers that invol...