硝酸羟胺的热稳定性评估及热分解机理研究

为评估氧化剂硝酸羟胺的热稳定性,使用标准液体铝皿于3K/min、4K/min、5K/min加热速率下进行热分析。借助非等温DSC曲线的参数值,应用Kissinger法和Ozawa法求得热分解反应的表观活化能和指前因子,根据Zhang-Hu-Xie-Li公式、Hu-Yang-Liang-Xie公式、Hu-Zhao-Gao公式以及Zhao-Hu-Gao公式,计算硝酸羟胺的自加速分解温度和热爆炸临界温度,并对热分解机理函数进行了研究。设计了7条热分解反应路径,采用密度泛函理论B3LYP/6-311++G(d,p)方法对硝酸羟胺的热分解进行了动力学和热力学计算。计算结果表明,硝酸羟胺热分解的自加速分解温度TSADT=370.05K,热爆炸临界温度Tbe0=388.68K,Tbp0=397.54K,热分解最可几机理函数的微分形式为f(α)=17×(1-α)18/17。硝酸羟胺热分解各路径中,动力学优先支持路径Path 6、Path 5、Path 4和Path 1生成NO和NO_2,其次是Path 2、Path 7和Path 3生成N2和N_2O。温度在373K以下时,Path 1′反应无法自发进行,硝酸羟胺无法进行自发的热分解。从热力学的角度来看,硝酸羟胺在370.05K以下储存是安全的。     

Experimental Study on Tunable Electromagnetic Shielding by Microlattice Materials with Organized Microstructures

Porous metal materials are widely used for preventing electromagnetic interference, control of heat conduction and impact absorbing. However, a limitation associated with porous metals is that their irregular and non‐uniformal microstructures make their functions non‐desirably tunable. In this report, the authors propose a microlattice material with precisely controlled microstructures for electromagnetic (EM) shielding. An effective medium model taking into account of the EM stimulated surface current of the metal wires is developed to characterize the EM shielding effect of the microlattice metal. In addition, a compact and integrated measuring device is constructed by using a 3D printing method for experimental verification. The theoretical predictions agree well with the experimental measurement. The influence of the geometrical parameters of the microlattice metals on EM shielding effect is also studied. The theoretical model and the compact measuring system provide robust and efficient tools for the design of EM shielding materials.

     

Zirconium Alloys for Orthopaedic and Dental Applications

Zirconium alloys for biomedical applications are receiving increasing attention due to their two unique properties: 1) the formation of an intrinsic bone‐like apatite layer on their surfaces in body environments, and 2) better compatibility with magnetic resonance imaging (MRI) diagnostics due to their low magnetic susceptibility, as well as their overall excellent biocompatibility, mechanical properties, and bio‐corrosion resistance. In particular, since both of the MRI quality and speed depend on magnetic field strength, there is a compelling drive for use of high magnetic field strength (>3 Tesla) MRI systems. This paper provides a comprehensive review of the characteristics of commercially pure (CP) Zr and Zr‐based alloys as orthopaedic and dental implant materials. These include their 1) phase transformations; 2) unique properties including corrosion resistance, biocompatibility, magnetic susceptibility, shape memory effect, and super‐elasticity; 3) mechanical properties; 4) current orthopaedic and dental applications; and 5) the d‐electron theory for Zr alloy design and novel Zr‐alloys. The mechanical properties of Zr‐based bulk metallic glasses (BMGs) and their application as implant materials are also assessed. Future directions for extending the use of Zr‐alloys as orthopaedic and dental implants are discussed.

     

Effect of end group of amorphous perfluoro-polymer electrets on electron trapping

Charge trap in amorphous perfluoro-polymer electret is studied, focusing on electron trap site and trap energy. Low-energy inverse photoelectron spectroscopy is adopted to measure solid-state electron affinity (EA) of cyclic transparent optical polymer (CYTOP). EA of CYTOP CTL-S is discovered by compensating the unwanted charge-up effect. Negatively-charged electret materials (polyethylene, ethylene-tetra-fluoro-ethylene, poly-tetra-fluoro-ethylene, and CYTOP) are analyzed by quantum mechanical calculation. Density functional theory with long-range correction is adopted to analyze orbital energies of single molecular systems. Intramolecular distribution of trapped electron and EA are investigated. Calculated electron affinities of CYTOP polymers with different end group are qualitatively in accordance with trapped charge stability measured with thermal stimulated discharge, signifying that electron affinities obtained with the present simulation can be used as an index of amorphous polymer electret.     

可伸缩复合材料悬臂梁的非线性动力学建模及分析

首先,根据Reddy给出的考虑高阶剪切效应的层合理论,气动弹性活塞理论,利用Hamilton原理,对考虑采用基于活塞理论的一阶非线性气动力和面内参数激励的联合作用下的轴向可伸缩复合材料悬臂梁进行非线性动力学进行建模,得到其偏微分动力学控制方程.然后对控制方程无量纲化,利用Galerkin方法对控制方程进行了截断,得到三个可反映可伸缩悬臂梁横向振动的无量纲形式的常微分非线性动力学方程,只要选取适合的复合材料及其相关参数,使用数值方法就对模型在外伸和回收过程中的相关振动特性进行了分析.     

基于TRIZ解决航空航天用吸波贴片成本高的问题

目的 解决隐身飞机在飞行过程中因吸波贴片自身过重产生巨大的飞行成本,吸波贴片在飞行条件下易产生划痕、损伤、材料损耗快,以及因修复工序复杂、耗时长产生大量维护费用等问题。方法 应用TRIZ理论进行分析求解,通过采用功能模型分析、因果分析等找到航空航天用吸波贴片成本高的关键缺陷,利用技术矛盾分析、物理矛盾分析、物场模型及标准解、小人法等工具得到多个解决方案。经过综合评估最终找到经济、易于实现的解决方案。结果 通过运用TRIZ理论,并且通过综合评价找到了减少吸波贴片成本的最优方案：吸波贴片中的吸波体由掺杂杂原子的石墨烯构成了多孔结构,增加了其吸波性能;再将材料与自愈合材料相结合,增加其自愈能力,从而得到吸波性能好、质量小、自愈合能力强的吸波贴片。结论 文中得出的结果对减少隐身战机吸波贴片成本的研究具有一定的理论指导意义,有助于减少高集成设备过多对人类及环境产生的危害。     

Sample regeneration algorithm for structural failure probability function estimation

An efficient strategy to approximate the failure probability function in structural reliability problems is proposed. The failure probability function (FPF) is defined as the failure probability of the structure expressed as a function of the design parameters, which in this study are considered to be distribution parameters of random variables representing uncertain model quantities. The task of determining the FPF is commonly numerically demanding since repeated reliability analyses are required. The proposed strategy is based on the concept of augmented reliability analysis, which only requires a single run of a simulation-based reliability method. This paper introduces a new sample regeneration algorithm that allows to generate the required failure samples of design parameters without any additional evaluation of the structural response. In this way, efficiency is further improved while ensuring high accuracy in the estimation of the FPF. To illustrate the efficiency and effectiveness of the method, case studies involving a turbine disk and an aircraft inner flap are included in this study.     

A review on mechanisms and recent developments of nanomaterials based carbon fiber reinforced composites for enhanced interface performance

Carbon fiber reinforced composites have attracted lots of attention in many fields. However, on account of the poor infiltration of resin to carbon fiber, the weak interface performance between fiber and resin has been restricting the interface properties of composites. In recent progress, the review attaches more importance to the introduction of the third phase monomer, which mainly uses physical and chemical methods to assemble nanomaterials (such as carbon nanotubes, graphene, etc.) on the carbon fiber surface to modify the interface structure of the carbon fiber reinforced composites, and all of them have been demonstrated in this paper. Furthermore, the effects of introducing nanomaterials on the structure of the fiber/resin interface and the relationship between multi-scale interface structure and properties have been investigated. It can be seen that the design idea of researchers mainly uses one or more theories to improve the interface properties of carbon fiber reinforced composites, such as transition layer, chemical bonding, mechanical interlocking, infiltration, diffusion, and adsorption. In brief, this work provides some novel insights for the preparation of carbon fiber reinforced composites with excellent interlaminar shear strength.     

基于群论方法的苯分子振动模式研究

苯(C₆H₆)作为大气和室内环境中的主要污染物,具有强烈致癌性,是大气环境主要监测的内容之一。基于群论方法分析建立一种苯分子的泛频跃迁谱线计算方法,利用苯分子简正振动模式与光谱活性,获得30个振动模式的振动频率及其不可约表示。基于D₆点群乘法规则,给出苯分子泛频跃迁的振动模式、光谱活性与谱线位置,为后续精确测量近红外区域苯分子未知谱线跃迁提供了数据与理论支撑。