压电材料中的微裂纹屏蔽问题分析

分析当主裂纹与一个微裂纹在远场I型力（KI）和远场电位移（Ke)作用下的相互干涉问题,得出了在微裂纹的位置角和方向角周时独立变化时,微裂纹对主裂纹的屏蔽作用的全局使命主裂纹扩展,通过电算还发现Ortiz在各向同性材料和各向异性材料中得出的“微裂纹群对主裂纹最大屏蔽效应产生在微裂纹方向与最大主应力垂直的方向”在压电材料中不再成立,进而提出除Hutchinson指出微裂纹屏蔽效应两个来源（即：材料有效刚度的降低和残余应力的释放）外的另一个来源,微裂纹对主裂砂电场的扰动,在对主微裂纹J积分分析时发现J2积分与J1积分具有同等重要的地位。     

碳纳米纤维负载钯催化剂的制备及其催化性能研究

通过静电纺丝和碳化技术,将聚丙烯腈制备成碳纳米纤维并用于负载钯催化剂.扫描电镜(SEM)表征结果显示,碳化过程虽使部分纤维融合,但纤维结构保持良好;透射电镜(TEM)图显示,碳化过程中Pd原子有一定程度地聚集,形成了直径约为15nm的颗粒.催化结果表明,该催化剂对碘代芳烃和丙烯酸酯的Heck偶联反应具有良好的催化活性,生成物反式肉硅酸酯的产率较高;该催化剂至少可以重复使用5次（保持催化活性不变）,显示出良好的稳定性.     

火灾烟颗粒的分形结构形状模拟与光散射计算

针对火灾烟颗粒的形状特点，提出并建立火灾烟颗粒分形结构凝团的形状模型，并对烟颗粒扫描电镜(SEM)图像进行分析，获取分形结构模型中的单个凝团中基本颗粒个数、凝团分形维数、基本颗粒半径等参数.利用该模型对火灾烟颗粒的形状进行模拟的结果表明，该模型能够较好反映出烟颗粒的形貌特征.利用形状模型对火灾烟颗粒散射进行初步计算表明，在其他参数相同的情况下，相对于同体积的球形颗粒，分形凝团具有前向散射较弱，后向散射较强的特征.     

First-principles investigation on the elastic stability and thermodynamic properties of Ti2SC

Using Vanderbilt-type plane-wave ultrasoft pseudopotentials within the generalized gradient approximation（GGA） in the frame of density functional theory（DFT）,we have investigated the crystal structures,elastic,and thermodynamic properties for Ti2SC under high temperature and high pressure.The calculated pressure dependence of the lattice volume is in excellent agreement with the experimental results.The calculated structural parameter of the Ti atom experienced a subtle increase with applied pressures and the increase suspended under higher pressures.The elastic constants calculations demonstrated that the crystal lattice is still stable up to 200 GPa.Investigations on the elastic properties show that the c axis is stiffer than the a axis,which is consistent with the larger longitudinal elastic constants（C 33,C 11） relative to transverse ones（C 44,C 12,C 13）.Study on Poisson＇s ratio confirmed that the higher ionic or weaker covalent contribution in intra-atomic bonding for Ti2SC should be assumed and the nature of ionic increased with pressure.The ratio（B/G） of bulk（B） and shear（G） moduli as well as B/C 44 demonstrated the brittleness of Ti2SC at ambient conditions and the brittleness decreased with pressure.Moreover,the isothermal and adiabatic bulk moduli displayed opposite temperature dependence under different pressures.Again,we observed that the Debye temperature and Gru篓neisen parameter show weak temperature dependence relative to the thermal expansion coefficient,entropy,and heat capacity,from which the pressure effects are clearly seen.     

He-NO碰撞体系微分截面的理论计算

首先用Huxley势函数形式拟合了在RCCSD(T)/aug-cc-pVTZ+bf理论水平下计算的He-NO相互作用能数据，获得了He原子与NO分子相互作用的各向异性势，然后采用密耦近似方法计算了He-NO碰撞体系的总微分截面、弹性微分截面和非弹性微分截面，并总结了微分散射截面的变化规律. 结果表明，拟合势不但表达形式简洁，而且较好地描述了He-NO系统相互作用的各向异性特征；利用碰撞体系分子间势的量子化学从头计算结果,可解决势能参数难以确定的问题，对进一步研究原子与分子碰撞机理有一定参考价值. 关键词： 各向异性势 势能参数 密耦近似 微分截面     

Theoretical calculation of the partial cross section for first vibrational excitation in He-H2（D2,T2） collisions

In this paper, close-coupling method was applied to the He-H2 （D2,T2） system, and the first vibrational excitation cross sections of ＇00-10, 00-12, 00-14, 00-16＇ at different incident energy have been calculated. By analyzing the ditferences of these partial wave cross sections, this paper have obtained the change rules of the partial wave cross sections with increases of quantum number, and with change of reduced mass of system. Based on the calculation, influence on the partial wave cross sections brought by the variations in the reduced mass of systems and in the relative kinetic energy of incident atoms is discussed.[第一段]     

Weight functions for interface cracks in dissimilar anisotropic materials

Bueckner‘s work conjugate integral customarily adopted for linear elastic materials is established for an interface crack in dissimilar anisotropic materials. The difficulties in separating Stroh‘s six complex arguments involved in the integral for the dissimilar materials are overcome and then the explicit function representations of the integral are given and studied in detail. It is found that the pseudo-orthogonal properties of the eigenfunction expansion form (EEF) for a crack presented previously in isotropic elastic cases, in isotopic bimaterial cases, and in orthotropic cases are also valid in the present dissimilar arbitrary anisotropic cases. The relation between Bueckner‘s work conjugate integral and the J-integral in these cases is obtained by introducing a complementary stressdisplacement state. Finally, some useful path-independent integrals and weight functions are proposed for calculating the crack tip parameters such as the stress intensity factors.     

在NiMnCo-Cu-C体系中生长宝石级金刚石单晶

利用温度梯度法在NiMnCo-Cu-C体系、于5.5 GPa、1250℃条件下进行了宝石级金刚石单晶的生长研究,结果发现,Cu片在触媒中的放置位置和其在金属触媒中所占体积分数对宝石级金刚石单晶的生长具有明显影响.当Cu片放置在碳源和触媒之间时,将不会有充足的碳源扩散到籽晶上,晶体无法生长;但放在触媒中其他位置,体积分数适当时,不会对晶体生长有明显影响.随着Cu体积分数增加,优质晶体生长将变得困难,当体积分数在20;时,晶体有生长,但晶体内部跟表面明显存在由于包裹体存在造成的生长坑洞;当体积分数在40;左右时,晶体将不再生长.不过当Cu在触媒中的体积分数适当时,会降低碳源在触媒中的输运,从而对抑制自发核生长起到一定的作用.     

小湾水电站坝址区低高程岸坡表生改造特征及机制研究

摘要：小湾水电站坝基、水垫塘边坡及低高程排水洞系统广泛地揭示了低高程岸坡的地质特征。基于现场调查和二维弹塑性有限元分析,深化认识了低高程岸坡表生改造特征：（1）它是在建造和构造改造的基础上进行的：原构造缓倾角节理扩展、错动;陡倾角节理扩展、产状改变以及错动;新生了大量中缓倾角裂隙;表生改造程度向坡内减弱。（2）建立了低高程岸坡表生改造缓裂生成机制模型,分析了其生成过程。（3）在二维弹塑性有限元分析中,基于拉破坏区分布、剪应变和点安全度等指标,分析了低高程岸坡卸荷松弛范围,其中谷底表生改造明显影响深度为6~9m。     

双惯导联合旋转调制光纤陀螺标度因数误差自校正方法

旋转调制光纤陀螺航海惯导系统中,光纤陀螺标度因数误差会与地球自转角速度耦合产生等效的天向和北向陀螺漂移误差,也会与船体摇摆角速度以及惯性测量单元旋转调制角速度耦合产生短时动态误差,限制了长航时航海惯性导航精度。通过使用两套三轴旋转调制光纤陀螺航海惯导系统进行联合旋转调制,提出一种光纤陀螺标度因数误差在线估计与自校正方法。根据两套三轴旋转调制光纤陀螺航海惯导系统的水平旋转轴空间夹角关系建立观测方程,实现在线估计滤波。半实物仿真结果表明,自主导航过程中光纤陀螺标度因数误差在线估计精度优于1 ppm,利用输出校正方式在线补偿光纤陀螺标度因数误差导致的惯导定位误差,有效抑制了两套三轴旋转调制光纤陀螺航海惯导系统定位误差的增长。实际转台模拟实验中,两套三轴旋转调制光纤陀螺惯导系统300 h纯惯性导航整体定位最大误差分别减小25%和40%。算法采用地心地固坐标系,因此也适用于极区导航情况。