富镧混合稀土对ZL101A合金组织和机械性能的影响

研究了富镧混合稀土对ＺＬ１０１Ａ合金的铸态、固溶态、Ｔ６状态、重熔态的组织和机械性能的影响，提出了混合稀土中入量低压铸造整体车轮合理的热处理状态。     

分子力场进展

分子力学（简称ＭＭ）是近年来化学家常用的一种计算方法。与量子力学从头计算和半经验方法相比，用分子力学处理大分子可以大大节省计算时间，而且，在大多数情况下，用分子力学方法计算得到的分子几何构型参数与实验值之间的差值可在实验误差范围之内。所以，分子力学是研究生物化学体系的有效和可行的手段。分子力学的核心是分子力场。本文介绍了分子力场的量子力学背景、分子力场和光谱力场之间的关系。分子力场的一般形式、分力     

Characterization and Three-dimensional Structural Modeling of Humic Acid via Molecular Mechanics and Molecular Dynamic Simulation

The humic acid（HA） sample obtained from the alluvial soil was characterized by elemental composition, pyrolysis gas chromatography-mass spectrometry（Py-GC-MS） and solid-state 13C nuclear magnetic resonance （13C NMR） spectroscopy. There is high fat content and a few nitrogen-containing functional groups in HA. Py-GC-MS demonstrates the characterization and structural identification of HA. One long list of identified pyrolysis products was proposed for the construction of conceptual model of HA. Solid-state 13C NMR data indicate there are higher values of alkyl-C, O-alkyl-C and aryl-C in HA. The elemental composition, structural carbon distribution and L3C NMR spectroscopy of simulated HA are consistent with those of experimental HA. HyperChem was used to simulate the three-dimensional molecular structure of the monomer, which was optimized by the molecular mechanics of the optimized potential for liquid simulations（OPLS） force field and molecular dynamics simulation to get the stable and balanced conformation. The deprotonation process study depicts that the degree of ionization of HA gets deeper, while the electronegativity of HA and the energy of van der Waals（vdW） increase. Moreover, the 3D structure of humic acid with -4 charges is the most stable. The deprotonation process is an endothermic process.     

异丁烷与丁烯烷基化反应的热力学分析

对异丁烷与丁烯烷基化反应进行了较为详尽的热力学分析和计算,得到了不同反应温度下的焓值、吉布斯自由能和反应平衡常数,并且对温度、压力和惰性物质对热力学平衡的影响进行了分析。得到了详细的烷基化反应热力学基础数据,这些数据对研究异丁烷与丁烯的烷基化反应具有重要的参考价值。     

Dynamic Mechanical Behavior and Prediction for PP/POE Blends

Polypropylene(PP)/ethylene-octene copolymer(POE) blends were prepared with a twin-screw extruder.Their dynamic mechanical behavior were systematically investigated.The results show that PP/POE blends are heterogeneities with a partial compatible two-phase structure,the glass transition temperature of PP phases in the blends tends to shift towards high temperature with increasing the POE content,and the glass transition temperature of POE phases shifts towards the low temperature with increasing the PP conte...     

Partial oxidation of simulated hot coke oven gas to syngas over Ru-Ni/Mg（Al）O catalyst in a ceramic membrane reactor

Hydrogen amplification from simulated hot coke oven gas (HCOG) was investigated in a BaCo0.7Fe0.2Nb0.1O3−δ (BCFNO) membrane reactor combined with a Ru-Ni/Mg(Al)O catalyst by the partial oxidation of hydrocarbon compounds under atmospheric pressure. Under optimized reaction conditions, the dense oxygen permeable membrane had an oxygen permeation flux around 13.3 ml/(cm2·min). By reforming of the toluene and methane, the amount of H2 in the reaction effluent gas was about 2 times more than that of original H2 in simulated HCOG. The Ru-Ni/Mg(Al)O catalyst used in the membrane reactor possessed good catalytic activity and resistance to coking. After the activity test, a small amount of whisker carbon was observed on the used catalyst, and most of them could be removed in the hydrogen-rich atmosphere, implying that the carbon deposition formed on the catalyst might be a reversible process.     

助剂CuO和La2O3对NiO/α-Al2O3甲烷催化部分氧化制合成气引发过程的影响

采用分步浸渍法制备了NiO/α-Al₂O₃、NiO-CuO/α-Al₂O₃和NiO-La₂O₃/α-Al₂O₃三种催化剂,运用程序升温表面反应（TPSR）技术考察了助剂CuO和La₂O₃对NiO/α-Al₂O₃甲烷催化部分氧化（CPOM）反应引发过程的影响。结果表明,无论是否经过预还原处理,NiO/α-Al₂O₃催化剂在CH₄/O₂混合气氛下进行程序升温表面反应（CH₄/O₂-TPSR）时,即使升高到910℃也不能引发CPOM反应。添加助剂CuO或La₂O₃后,NiO-CuO/α-Al₂O₃和NiO-La₂O₃/α-Al₂O₃催化剂在CH₄/O₂-TPSR过程中均可以引发CPOM反应。原因分别是CuO促进了CH₄对NiO的还原以及抑制了O₂对Ni0的再氧化,La₂O₃减小了Ni晶粒粒径和还原时扩散阻力促进NiO的还原。     

复合材料模量细观分析的一般性模型

基于细观力学理论,提出了横观各向异性复合材料弹性常数的分析模型,并给出了纵向(纤维长度方向) 与横向弹性模量、横截面内剪切模量和泊松比等材料性能参数的理论推导和计算公式. 此方法简洁准确地反映了材料横观各向异性性能,改进了常规细观力学模型,也为工程分析提供了理论依据;同时在复合材料力学课程教学中,有助于深化学生对复合材料细观分析的理解,具有一定的启发性.     

黄瓜卷须Ⅰ:自盘卷拉拽

黄瓜卷须自盘卷形成的螺旋弹簧与普通的弹簧不同,存在“换向节”(变换螺旋的旋向,使左手螺旋为右手螺旋,或者反过来),使卷须在两端固定(拴住)的情形下能够自盘卷拉拽.老卷须具有奇妙的力学行为,受拉时盘卷圈数不是减少,而是增加,拉伸刚度也增加,实现了固定和保护植株的功能优化.第Ⅱ部分将继续探源其中的力学机理,介绍黄瓜卷须的组织、力学模型和北京航空航天大学据此开发的选修实验.     

《应用力学学报》征稿简则

《应用力学学报》是由国家科委审批公开发行的中央级学术刊物。本刊自2011年起改为双月刊,双月中旬出版。本刊主要反映现代力学在工程实际中的应用,及时交流运用近代力学理论、计算方法和实验技术在解决工程实际问题中取得的新成果。涉及的内容包括流体、振动、强度等。本刊设有