Spatially restricted Double Z-Simplified Box Orbital basis sets: Optimization and comparison with some standard basis sets

As part of previous studies, we introduced a new type of basis function named Simplified Box Orbitals (SBOs) that belong to a class of spatially restricted functions which allow the zero differential overlap (ZDO) approximation to be applied with complete accuracy. The original SBOs and their Gaussian expansions SBO-3G form a minimal basis set, which was compared to the standard Slater-type orbital basis set (STO-3G). In the present paper, we have developed the SBO basis functions at double-zeta (DZ) level, and we have assessed the option of expanding the SBO-DZ as a combination of Gaussian functions. Finally, we have determined the quality of the new basis set by comparing the molecular properties calculated with SBO-nG with those achieved with some standard basis sets.     

Synthesis of Piperidine Nucleosides as Conformationally Restricted Immucillin Mimics

The de novo synthesis of piperidine nucleosides from our homologating agent 5,6-dihydro-1,4-dithiin is herein reported. The structure and conformation of nucleosides were conceived to faithfully resemble the well-known nucleoside drugs Immucillins H and A in their bioactive conformation. NMR analysis of the synthesized compounds confirmed that they adopt an iminosugar conformation bearing the nucleobases and the hydroxyl groups in the appropriate orientation.     

限制pre-李代数

研究限制pre-李代数的结构,给出了限制pre-李代数和可限制pre-李代数的定义,得到了限制pre-李代数的p-映射性质和可限制pre-李代数的性质,还讨论了带有半单元的限制pre-李代数及拟环面限制pre-李代数和分解唯一性定理.     

深海远程正交频分复用水声通信簇约束的分布式 压缩感知信道估计*

在深海远程正交频分复用(Orthogonal Frequency Division Multiplexing,OFDM)水声通信中,信道时延较长,导致信道频率选择性衰落严重,传统的压缩感知信道估计算法性能大幅下降。为此,本文利用深海远程信道在一定时间内具有相关性并呈较稳定簇状分布的特点,在分布式压缩感知信道估计中引入簇区域信息,进行簇约束的多数据块联合稀疏信道估计,提出一种簇约束的分布式压缩感知信道估计方法,并在深海开展了定点远程水声通信实验进行验证,实验结果表明,与传统的分布式压缩感知信道估计算法相比,本方法的能够降低50%左右的误码率。     

The annular twist mapping of the restricted three-body problem

This paper presents a new derivation of the twist mapping in the planar restricted problem. It differs from other treatments in the use of a novel canonical transformation which allows for the utilization of symplectic reduction techniques.     

Apollonius coordinates,theN-body problem,and continuation of periodic solutions

This paper treats theN-body problem and its relation to various restricted problems. For each solution of the Kepler problem a generalization of the pulsating coordinates used to express the Hamiltonian of the elliptic restricted three-body problem is given. These coordinates are called Apollonius coordinates. The method of symplectic scaling is used to give a precise derivation of the elliptic restricted problem showing the precise asymptotic relationship between the restricted problem and the full three-body problem. This derivation obviates the proof of the fact that a nondegenerate periodic solution of the elliptic restricted three-body problem can be continued into the full three-body problem under mild nonresonance assumptions. Also, the method of symplectic scaling is used to give a precise derivation of the elliptic Hill lunar equation showing the precise relationship between the elliptic Hill lunar equation and the full three-body problem. A similar continuation theorem is established.     

STUDIES OF MELNIKOV METHOD AND TRANSVERSAL HOMOCLINIC ORBITS IN THE CIRCULAR PLANAR RESTRICTED THREE－BODY PROBLEM

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Monte Carlo Simulations of Observation Time-Dependent Self-Diffusion in Porous Media Models

Observation time-dependent self-diffusion coefficients can be used to obtain microstructural information of porous media. This paper presents two different kinds of Monte Carlo simulations of the self diffusion process of fluids like water in porous systems, a lattice-free method and a lattice-based method. The results for simple porous media model geometries agree well with each other and with published analytical as well as semi-analytical equations. The use of these equations, which are important for the interpretation of Pulsed Field Gradient-Nuclear Magnetic Resonance (PFG-NMR) time-dependent diffusion data with respect to properties of porous media, is discussed.     

基于ANP法的股权激励模式选择研究

本文对企业如何科学合理地选择股权激励模式问题进行研究探讨。不仅考虑到以往研究中的企业特征因素,同时也考虑了激励对象特征因素和外部实施环境因素,建立股权激励模式选择指标体系,并分析各指标间的依存关系,基于此构建了ANP网络结构模型,并选取两个代表性样本企业进行算例验证和应用,最终使得不同企业可根据自身的实际情况选择合适的股权激励模式,验证了该模型的合理性与可行性。     

半定矩阵秩极小的非凸精确松弛

本文主要研究半定矩阵秩极小问题(P)的非凸精确松弛及其性质.首先,为求解问题(P),我们引入其Schatten p-范数(0＜p＜1)松弛,记为(Sp).其次,通过定义半定限制等距常数和半定限制正交常数,我们给出了问题(P)有唯—解的充分条件.最后,利用半定限制等距性质,我们给出了问题(P)和(Sp)有相同唯一解的充分条件.特别地,对任意0＜p＜1,我们还得到—个一致的精确恢复条件.