Cauchy-Born Rule and the Stability of Crystalline Solids： Dynamic Problems

We study continuum and atomistic models for the elastodynamics of crystalline solids at zerotemperature.We establish sharp criterion for the regime of validity of the nonlinear elastic wave equationsderived from the well-known Cauchy-Born rule.     

液-固色谱流动相体积分数层次结构模型与保留值的关系

用液-固色谱流动相"假定"的体积分数层次结构模型,可得到质点团溶解溶质时的体积分数,进而得到共溶剂中溶质的溶解度、固定相上的溶质吸附量,从而推导出多元流动相组成与溶质保留值的关系.如三元流动相与溶质保留值的关联式为:lnk'=φB3lnk'B3 φB2lnk'B2 φB1lnk'B1 φB1(φB20.5 φB30.5)ln(q)(外Ⅱ) φB30.5φB21.0φB11.5ln(q)(外Ⅰ),经实验数据拟合,本式较其他关联式略胜一筹.     

Scale invariance rule in electromagnetic scattering

The volume integral equation formalism is used to prove the scale invariance rule for an arbitrarily sized scatterer with an arbitrary shape, morphology, and orientation. The only assumptions are that the scatterer is made of optically isotropic linear materials and is embedded in a homogeneous, linear, isotropic, and nonabsorbing infinite medium.     

High spin chemistry underlying organic molecular magnetism: Topological symmetry rule as the first principle of spin alignment in organic open-shell systems of π-conjugation and their ions

This review paper deals with an overview of molecule-based magnetism as a rapidly developing interdisciplinary field, topological symmetry rule as the first principle of spin alignment in organic open-shell systems in the ground state, the proposal of organic through-bond 1D and 2D ferro- and superparamagnets and the detection of the first organic high-spin molecule, m-phenylenebis(phenylmethylene) in the quintet ground state (S = 2), followed by extended organic high-spin systems with π-conjugation such as aromatic hydrocarbons having S = 3, 4, 5. The paper also describes a theoretical approach to the understanding of electronic spin structures of organic high-spin molecules by invoking both Heisenberg and Hubbard model Hamiltonians, weakly interacting intramolecular high-spin systems from both experimental and theoretical sides, the spin density distribution of the first organic high-spin molecule in terms of electron- nuclear multiple resonance spectroscopy and the detection and characterization of ionic high-spin hydrocarbons, emphasizing the establishment of high spin chemistry underlying organic molecular magnetism.     

Unexpected end‐groups of poly(acrylic acid) prepared by RAFT polymerization

Low‐molecular‐weight poly(acrylic acid) (PAA) was synthesized by reversible addition fragmentation chain transfer polymerization with a trithiocarbonate as chain‐transfer agent (CTA). With a combination of NMR spectroscopy and matrix‐assisted laser desorption/ionization time‐of‐flight mass spectrometry, the PAA end‐groups of the polymer were analyzed before and after neutralization by sodium hydroxide. The polymer prior to neutralization is made up of the expected trithiocarbonate chain‐ends and of the H‐terminated chains issued from a reaction of transfer to solvent. After neutralization, the trithiocarbonates are transformed into thiols, disulfides, thiolactones, and additional H‐terminated chains. By quantifying the different end‐groups, it was possible to demonstrate that fragmentation is the rate limiting step in the transfer reaction. © 2004 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 42: 5439–5462, 2004     

Reversible addition–fragmentation transfer (RAFT) copolymerization of methyl methacrylate and styrene in miniemulsion

In the reversible addition–fragmentation transfer (RAFT) copolymerization of two monomers, even with the simple terminal model, there are two kinds of macroradical and two kinds of polymeric RAFT agent with different R groups. Because the structure of the R group could exert a significant influence on the RAFT process, RAFT copolymerization may behave differently from RAFT homopolymerization. The RAFT copolymerization of methyl methacrylate (MMA) and styrene (St) in miniemulsion was investigated. The performance of the RAFT copolymerization of MMA/St in miniemulsion was found to be dependent on the feed monomer compositions. When St is dominant in the feed monomer composition, RAFT copolymerization is well controlled in the whole range of monomer conversion. However, when MMA is dominant, RAFT copolymerization may be, in some cases, out of control in the late stage of copolymerization, and characterized by a fast increase in the polydispersity index (PDI). The RAFT process was found to have little influence on composition evolution during copolymerization. The synthesis of the well‐defined gradient copolymers and poly[St‐b‐(St‐co‐MMA)] block copolymer by RAFT miniemulsion copolymerization was also demonstrated. © 2004 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 42: 6248–6258, 2004     

一类广义积分integral from n=0 to ∞(((sin(θ_x))/x)~ndx)的计算

利用三角函数幂公式、L′Hospital法则、分部积分公式,得到含有三角函数的第一类广义积分integral from n=0 to ∞(((sin(θ_x))/x)~ndx)的计算公式,其中n≥1且θ≠0.     

承受拉-扭组合载荷的薄壁圆筒屈服时产生塑性流动的条件

提出了在无外力作功的情况下，具有Bauschinger效应的弹塑性材料处于屈服状态产生自发的塑性流动时应满足的条件．这个条件不仅与材料的力学性能有关，而且还处决于材料的具体的载荷边界条件和变形．举例说明了承受拉一扭组合的薄壁圆筒中，采用组合强化模型时，产生塑性流动的具体条件．     

一种有交易费用的交互式组合证券投资方法

本基于乘积最大化准则，提出一种新的交互式组合证券投资方法，即将不可微的双目标规划问题转化为可微的单目标规划问题。该方法可以充分考虑投资的要求，在考虑交易费用的前提下，在整个投资方案达到投资要求底限的同时，实现收益和风险的权衡。     

Algorithms for Finite and Semi-Infinite Min–Max–Min Problems Using Adaptive Smoothing Techniques

We develop two implementable algorithms, the first for the solution of finite and the second for the solution of semi-infinite min-max-min problems. A smoothing technique (together with discretization for the semi-infinite case) is used to construct a sequence of approximating finite min-max problems, which are solved with increasing precision. The smoothing and discretization approximations are initially coarse, but are made progressively finer as the number of iterations is increased. This reduces the potential ill-conditioning due to high smoothing precision parameter values and computational cost due to high levels of discretization. The behavior of the algorithms is illustrated with three semi-infinite numerical examples.