Novel supramolecular polymer networks based on melamine‐ and imide‐containing oligomers

Reversible, supramolecular polymer networks based on commercially available bulk chemicals, and prepared using an industrially attractive route are described. The difunctional, low molecular weight polytetramethyleneoxide is functionalized with trimellitic imide, and reversibly crosslinked with the trifunctional melamine using the well known imide‐diaminopyridine triple hydrogen bonding pattern. Molecular modelling calculations as well as experimental studies on model compounds indicate that the aimed 1:3 melamine ‐ imide stoichiometry is obtained. The resulting reversible, supramolecular polymer structures show a rheological behaviour, that is typical for polymer networks. The results presented here describe an industrially accessible route to use supramolecular interactions in order to obtain materials with novel properties.     

A New Method for Solution of 3D Elastic-Plastic Frictional Contact Problems

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Low Pressure Carbonylation of Benzyl Carbonates and Carbamates for Applications in 13C Isotope Labeling and Catalytic CO2 Reduction

Herein, we report a methodology to access isotopically labeled esters and amides from carbonates and carbamates employing an oxygen deletion strategy. This methodology utilizes a decarboxylative carbonylation approach for isotope labeling with near stoichiometric, ex situ generated ¹²C, or ¹³C carbon monoxide. This reaction is characterized by its broad scope, functional group tolerance, and high yields, which is showcased with the synthesis of structurally complex molecules. A complementary method that operates by the catalytic in situ generation of CO via the reduction of CO₂ liberated during decarboxylation has also been developed as a proof-of-concept approach that CO₂-derived compounds can be converted to CO-containing frameworks. Mechanistic studies provide insight into the catalytic steps which highlight the impact of ligand choice to overcome challenges associated with low-pressure carbonylation methodologies, along with rational for the development of future methodologies.     

Elucidating the relationship between the spreading coefficient, surface-mediated partial coalescence and the whipping time of artificial cream

We studied the whipping of artificial creams composed of a blend of sunflower oil and hydrogenated palm fat stabilized by protein or a mixture or protein and low molecular weight (lmw) surfactant. It was found that an increased whipping speed, decreased protein concentration, and the addition of lmw surfactant leads to shorter whipping times. Further, shorter whipping times were observed for WPI-stabilized cream compared to cream stabilized by sodium caseinate. In all cases, the decrease in whipping time was due to a decrease in the length of the second stage of whipping, the stage characterized by the adhesion of fat droplets to the air bubble surface. The decrease in whipping time could be accounted for by considering the influence of the experimental variables on the fraction of bubble surface area at which fat droplet spreading is possible. The same changes in parameters that promote droplet spreading at the air/water interface cause a decrease in the whipping time of our model creams. Correlating the whipping time of cream with the spreading behavior of fat droplets at the air/water interface represents a new insight into the mechanisms involved in the whipping of cream.     

新型O-取代苯磺酰羟胺化合物的合成及其热性能

以O-取代苯磺酰氯和乙酰羟肟酸乙酯为原料,经消除、水解反应合成了6个新型的O-取代苯磺酰羟胺化合物：O-2-硝基苯磺酰羟胺、O-3-硝基苯磺酰羟胺、O-2,4-二硝基苯磺酰羟胺、O-2,4-二甲基苯磺酰羟胺、O-2,4,6-三甲基苯磺酰羟胺和O-2,4,6-三异丙基苯磺酰羟胺,其结构经¹H NMR, ¹³C NMR, IR和元素分析表征。并初步探讨了可能的反应机理。利用差示扫描量热分析(DSC)研究了化合物的热性能。结果表明：苯环上取代基供电子能力越强,化合物的热稳定性越好。     

具有散度形式的拟线性椭圆型微分方程的区域振动准则

对一类具有散度形式的拟线性椭圆型微分方程建立了若干新的振动准则,所得结果仅依赖于方程在外区域Ω(?)R~n的一个区域序列的信息而有别于已知的大多数结论.     

On the behavior of the solution of the Burgers equation as the viscosity goes to zero

The solution of the initial boundary-value problem u_?′ ? ?D²u_? + u_?Du_? = f on (a, b) x(0, T), u_?(a, t) = u_?(b, t) = 0 and u_?(x, 0) = 0 on (a, b), is shown to converge to the solution of the limiting equation as the viscosity tends to zero. Estimates on the rate of convergence are given.     

解Drucker-Prager塑性问题的二阶锥互补法

基于经典弹塑性理论中多数屈服准则具有凸锥数学结构的事实,将在大规模计算中更具潜力的锥规划法引入弹塑性分析。考虑到弹塑性流动理论有关联与非关联之分,本文提出利用锥型互补法求解弹塑性问题。具体以Drucker-Prager弹塑性模型为例,首先利用最大塑性功耗散原理和圆锥对偶理论等工具,建立了弹塑性本构方程的等价二阶锥互补模型;然后,基于参变量变分原理和有限元技术,建立了弹塑性增量分析的二阶锥线性互补模型;最后,利用一类半光滑Newton算法求解。数值算例表明了本文方法的有效性。     

颗粒材料内部滑动变形局部化的离散元模拟

颗粒材料在加载过程中表现出非常复杂的变形性质.在微观尺度上,单个颗粒的运动、单个孔隙胞元内的变形都是非均匀的,但也不是完全随机、没有规律可循的,而是呈现一定结构性的分布,如微带、剪切带等.本文用基于孔隙胞元的离散元方法对颗粒体进行双轴加载数值试验,模拟了以滑动变形表征的变形局部化现象.数值结果发现,对应加载过程中的不同...