Surface of room temperature ionic liquid [bmim][PF6] studied by polarization- and experimental configuration-dependent sum frequency generation vibrational spectroscopy

Understanding and control of the surface properties such as molecular orientations are of great importance in numerous applications of ionic liquids. However, there remain discrepancies among the previous experimental and theoretical studies on the surface orientation and structures of room temperature ionic liquids(RTIL) systems. In this article, the orientation of 1-butyl-3-methylimidazolium([bmin]) cation at the air/liquid interface of a characteristic RTIL, 1-butyl-3-methylimidazolium hexafluorophosphate([bmim][PF6]), was investigated by the sum frequency generation vibrational spectroscopy(SFG-VS). Detailed polarization and experimental configuration analyses of the SFG-VS spectra showed the possibility of a small spectral splitting in the CH3 symmetric stretching region, which can be further attributed to the probable existence of multiple orientations for the interfacial [bmim] cations. In addition, the(N)–CH3 vibrations were absent, ruling out the prediction by several recent molecular dynamics simulations which state that portions of the [bmim] cations orient with a standing-up(N)–CH3 group at the ionic liquid surface. Hence, new realistic theoretical models have to be developed to reflect the complex nature of the ionic liquid surface.     

Ratiometric mode with dyads: a breakthrough in dynamic trapping and quantification for redox regulation in living cells

Redox-based post-translational modification of protein thiols has become an attractive strategy in cellular homeostasis and cell signaling.Due to the reductive end of the redox buffer network,the vicinal dithiol-containing proteins(VDPs)maintains an appropriate oxidation-reduction state of proteins through the reversible transformation from vicinal dithiols to disulfide,which is responsible for a variety of     

各向异性本构关系在板料成形数值模拟中的应用

对几种能表达面内各向异性的屈服准则Hill、Barlat-Lian、Barlat进行了比较。以弹性变形服从各向同性广义虎克定律的情况下，给出了基于张量算法推导的弹塑性本构关系的一般表达式，并由此导出了相应屈服准则的弹塑性本构关系的显式表达。借助ABAQUS软件本构模块用户子程序接口，分别实现了这些屈服准则在ABAQUS的嵌入。以模拟方形盒的拉延过程为例，分析了不同的屈服准则在板料成形过程数值模拟中的应用。模拟结果表明，基于弹塑性本构关系一般表达所列出的相应屈服准则的显式表达式是正确的；在采用壳元来模拟板料成形时，采用Barlat准则的模拟结果和采用Barlat-Lian准则的结果差别不大。     

WKBJ近似保辛吗?

WKBJ短波近似是最常用的有效求解方法之一。保守体系的微分方程可用Hamilton体系的方法描述，其特点是保辛。保辛给出保守体系结构最重要的特性。但WKBJ短波近似却未曾考虑保辛的问题。本文给出验证近似解保辛的条件，并指出WKBJ近似难于保辛。然后给出正则变换的摄动保辛方法。数值例题展示了提出的保辛算法的有效性。     

不同年龄段天然牙的摩擦磨损行为研究

采用往复滑动摩擦磨损试验台考察了不同年龄段的天然牙同钛合金配副时的摩擦学性能.结果表明:天然牙的摩擦磨损行为同年龄密切相关,早期和中期恒牙的摩擦磨损行为相似,磨损表面主要呈现轻微擦伤迹象,中期恒牙的抗磨性能最佳;乳牙及晚期恒牙的摩擦系数变化波动较大,抗磨性能不佳,磨损表面主要呈现严重犁削和剥落特征.     

INFLUENCE OF ASIAN DUSTS ON THE PHYSICOCHEMICAL PROPERTIES OF ATMOSPHERIC AEROSOLS IN TAIWAN DISTRICT USING THE PENGHU ISLANDS AS AN EXAMPLE

1. Introduction In the early months of each year, Asian dusts transport frequently from Northwest China and Mongolia to the Pa-cific-Rim countries (Kagawa et al., 2001; Uno et al., 2002). It causes significant environmental effects such as ambient air quality deterioration, atmospheric visibility impairment, radiation energy reduction, mineral deposition, and acid rain neutralization (Terada et al., 2002; Zhang & An, 1999). During Asian dust periods, significant increases of atmos-pheric …     

跳马项目的三维实时动态测量系统

为跳马项目研究的电测系统中引入数字信号处理的传递函数及频谱分析的方法,采集和处理了因人体冲击三维力对信号的耦合干扰造成的十分复杂的响应信号,具有较高的动态测试精度.可以获得跳马动作的全部运动生物力学参数.现已用于中国国家体操队进行计算机辅助训炼.     

La_2O_3和WSi_2增强MoSi_2基复合材料的摩擦磨损性能研究

选用MRH-5A型环-块摩擦磨损试验机测定了3种载荷和2种转速条件下La2O3和WSi2增强MoSi2基复合材料在滑动干摩擦时的摩擦磨损性能,采用扫描电子显微镜分析了复合材料磨损表面形貌.结果表明:La2O3和WSi2增强MoSi2基复合材料的抗磨性能优于MoSi2及WSi2/MoSi2材料;当载荷与速度乘积(pv)值小于183.04N·m/s时,La2O3和WSi2增强MoSi2基复合材料的磨损质量损失仅为相同条件下MoSi2的1/4～1/6和WSi2/MoSi2的1/2;这是由于La2O3和WSi2复合增强相存在硬化和韧化协同作用所致;随着pv值增加,La2O3和WSi2增强MoSi2基复合材料依次呈现犁削、粘着磨损和疲劳磨损特征.     

受控结构风振响应分析的广义虚拟激励法

基于复模态分析和虚拟激励法．提出了用于具有密集频率和非经典阻尼受控结构风振响应分析的广义虚拟激励法。该法可以考虑任意风谱和空间相关性以及模态耦合效应，且计算效率很高。不同于SRSS法．该算法包含了全部参振模态之间和全部激励点之间的相关性．在理论上是精确解。     

结构设计中的混沌优化方法及其改进

在变尺度混沌优化方法研究中．结合结构优化问题的特点，提出了一种改进的混沌优化求解算法，用来解决带有多种约束条件的结构优化设计问题。在有限元分析和优化设计软件JEFIX中实现了上述算法．并通过数值算例讨论了变尺度混沌优化方法在结构优化中的可行性及存在的问题，得到了一些重要结论。