黏弹性理论中广义Maxwell模型的教学法及其在非晶态固体中的应用

黏弹性力学是固体力学研究的重要组成部分,如何开展黏弹性力学教学对于学生理解相关知识至关重要。本文以黏弹性力学最为经典的Maxwell模型为例展示整个教学过程：首先从基本黏弹性元件出发,推导Maxwell 模型及其广义表达式,然后结合非晶固体应力松弛实验曲线,从变形单元激活特征时间角度出发,将经典Maxwell模型应用于非晶固体变形,结合实际案例和计算练习来加深学生对于该模型的理解和应用。相比于传统黏弹性力学课程,本文考虑广义Maxwell模型中多个并联单元特征时间在对数时间尺度的Gauss分布形式,这对于非晶态固体的变形研究以及黏弹性理论的课程教学过程具有重要借鉴价值。

     

地下隧道开挖中饱水围岩的力学特性研究

为探究不同开挖方式对应的卸荷速率对饱水围岩的影响,对饱水砂岩开展了常规三轴压缩试验和轴向位移不变的卸围压（速率为0.1~5 MPa/s）试验。结果表明：在卸围压试验中环向变形是破坏的主要原因;随着卸围压速率的增加,破坏点的围压和轴向主应力增加且位于常规三轴压缩包络线外,环向能、总能和耗散能的变化量呈V形变化,试样的破坏模式由共轭剪切破坏转化为张应变 + 共轭剪切混合破坏,试样的剪胀角随着塑性剪切应变的增加先降低后增加。

     

Far-Field Detection of Near-Field Circular Dichroism Enhancements Induced by a Nanoantenna

Nanophotonics can enhance the inherent weak signal exhibited by chiral molecules in circular dichroism (CD) spectroscopy experiments. One mechanism to achieve this CD enhancement is based on increasing the optical chirality produced by nanophotonics antennas in their near-field, where chiral molecules are placed. However, ascertaining whether this CD enhancement is reached presents significant experimental challenges due to the complexity of measuring near-field optical chirality. Here, it is demonstrated that a local and single measurement of the degree of circular polarization in the far-field enables quantifying near-field CD enhancements. Thereby, based on this far-field measurement, the optimal response of the antenna is predicted for enhanced chiral sensing. Experimental validation of this near-to-far-field relation is provided for silicon spherical nanoantennas. The experimental results, supported by analytical theory and exact numerical simulations, can be interesting for the experimental characterization of devices capable of enhancing CD from a single far-field Stokes measurement.     

Keating改良模型的硅纳米梁动态特性

提出一种用于分析硅纳米梁动态特性的改良型半连续体模型,对比传统的连续体理论,这种新模型使用了Keating势,并考虑了纳米梁在宽厚两个维度的分立特性。依据Sun-Zhang模型思想和能量守恒定律,建立了改良型Keating模型,并进行了双端固支梁的基频计算。在这个过程中,对一些表面效应也进行系统分析。结果表明,该改良模型一方面在纳米尺度下与Material StudioTM软件仿真结果较为符合,另一方面也能在微观尺度下较好的接近连续体模型的计算数据。同时,该模型还反映了基频随纳米梁宽度变化的特性,这也符合一些实际实验。     

Xylityl Sesquicaprylate Efficacy as an Antiseptic Ingredient for Oral Care Products (Mouthwash): An In Vitro Screening Investigation against Eight Microorganisms

For dental caries and periodontal diseases initiated by dental plaque (as bacterial communities) and to inhibit the growth of oral pathogenic bacteria, oral care products containing antiseptic active ingredients are highly recommended, nonetheless, side effects of such actives are a concern (teeth discoloration/staining and taste perception, for example). In this context, we challenged xylityl sesquicaprylate, an antiseptic compound from natural resources, as an active ingredient to be used in an alcohol-free mouthwash formulation. The xylityl sesquicaprylate sample was compared to a respective blank mouthwash formulation and one containing triclosan. The in vitro efficacy was screened by the time-kill assay against eight microorganisms. The xylityl sesquicaprylate-containing mouthwash (0.45% w/w) presented a particularly interesting profile of efficacy against Actinomyces viscosus, Fusobacterium nucleatum, Porphyromonas gingivalis, and Tannerella forsythia, with results of greater magnitude to reduce the log₁₀ of those microorganisms in comparison with the triclosan sample.     

Investigation of the Effect of Substituents on Electronic and Charge Transport Properties of Benzothiazole Derivatives

A series of new benzothiazole-derived donor–acceptor-based compounds (Comp1–4) were synthesized and characterized with the objective of tuning their multifunctional properties, i.e., charge transport, electronic, and optical. All the proposed structural formulations (Comp1–4) were commensurate using FTIR, ¹H NMR, ¹³C NMR, ESI-mass, UV–vis, and elemental analysis techniques. The effects of the electron-donating group (-CH₃) and electron-withdrawing group (-NO₂) on the optoelectronic and charge transfer properties were studied. The substituent effect on absorption was calculated at the TD-B3LYP/6-31+G** level in the gas and solvent phases. The effect of solvent polarity on the absorption spectra using various polar and nonpolar solvents, i.e., ethanol, acetone, DMF, and DMSO was investigated. Light was shed on the charge transport in benzothiazole compounds by calculating electron affinity, ionization potential, and reorganization energies. Furthermore, the synthesized compounds were used to prepare thin films on the FTO substrate to evaluate the charge carrier mobility and other related device parameters with the help of I-V characteristic measurements.     

Density Functional Theory Study of the Point Defects on KDP (100) and (101) Surfaces

Surface defects are usually associated with the formation of other forms of expansion defects in crystals, which have an impact on the crystals’ growth quality and optical properties. Thereby, the structure, stability, and electronic structure of the hydrogen and oxygen vacancy defects (V_H and V_O) on the (100) and (101) growth surfaces of KDP crystals were studied by using density functional theory. The effects of acidic and alkaline environments on the structure and properties of surface defects were also discussed. It has been found that the considered vacancy defects have different properties on the (100) and (101) surfaces, especially those that have been reported in the bulk KDP crystals. The (100) surface has a strong tolerance for surface V_H and V_O defects, while the V_O defect causes a large lattice relaxation on the (101) surface and introduces a deep defect level in the band gap, which damages the optical properties of KDP crystals. In addition, the results show that the acidic environment is conducive to the repair of the V_H defects on the surface and can eliminate the defect states introduced by the surface V_O defects, which is conducive to improving the quality of the crystal surface and reducing the defect density. Our study opens up a new way to understand the structure and properties of surface defects in KDP crystals, which are different from the bulk phase, and also provides a theoretical basis for experimentally regulating the surface defects in KDP crystals through an acidic environment.     

弓张式超磁致伸缩材料换能器的设计与分析

为了提高超磁致伸缩换能器的作动行程,以获得足够大的发音强度,并使之满足发音装置体积小、装配零件少的要求,结合超磁致伸缩材料（GMM）的优良特性,提出一种基于三角放大原理的弓张式GMM换能器。该换能器以GMM棒作为驱动元件,通过固定弓张结构的一端,将双向输出转变为单向输出,同时利用柔性铰链结构,进一步增大换能器的位移输出。通过分析换能器的工作原理,计算得到其理论放大倍数为2.73,与所建立的有限元仿真模型计算得到的放大倍数2.8相近。制作了试验样机并搭建了相应的试验系统,得到在1 kHz范围内换能器最大输出位移为15.5 m,与仿真结果14.058 m相近。提出的弓张结构实现了换能器的位移放大,相应的分析方法也较好地反映了换能器的输出特性。     

硬夹心矩形夹层板的整体稳定性分析

论文在Reissner型理论给出的位移模式基础上,修正其软夹心假设,考虑夹心层面内刚度,给出了硬夹心夹层板的几何方程、物理方程,建立了硬夹心夹层板结构在面内纵向载荷作用下的平衡微分方程,并对方程进行了简化,通过理论计算得到了四边简支条件下硬夹心矩形夹层板整体失稳临界载荷的解析解,并分别计算了夹心层材料的弹性模量E、厚度h、泊松比μc对硬夹心夹层板临界载荷的影响,结果证明,对于硬夹心夹层结构,夹心层面内刚度对硬夹心夹层板整体失稳临界载荷的影响较大,考虑其面内刚度是必要的.     

非均质Cosserat连续体细-宏观均匀化条件

基于平均场理论的多尺度模拟关键问题之一是给定恰当的代表性体积单元(RVE)的边界条件,以使均匀化过程满足Hill-Mandel细宏观能量等价条件,也即Hill宏观均匀化条件.对于非均质Cosserat连续体,已有的研究工作只能得到合理的混合平动位移-偶应力表征元边界条件,常用的一致平动位移-转角以及周期边界条件等均不能使用,给计算均匀化算法推导和实施带来了困难,也阻碍了多尺度分析方法的进一步发展与应用.为此,论文在推导和建立一个新的Hill定理版本基础上,不仅成功地给定了多种强形式表征元边界条件,而且构造出了合理的弱形式周期边界条件,这些条件既满足细宏观能量等价也符合一阶平均场理论基本假定,可在均匀化方法中推广与应用.