质子化丙酮分子团簇的结构和振动光谱

用密度泛函B3LYP/ 6 3 1G(d)方法 ,对质子化丙酮分子团簇 (CH3COCH3) nH+ (n =1～ 7)弱相互作用体系进行了全自由度能量梯度优化 ,得到了该系列团簇的稳定结构及其对应的体系能量 .通过对构型的分析得出了质子化丙酮分子团簇 (CH3COCH3) nH+ (n =1～ 7)的生长规律 .计算了中性丙酮分子团簇体系的质子亲合能并总结出其变化趋势 .分析讨论了质子化团簇的红外振动光谱 ,发现质子化团簇的振动光谱普遍较中性环型团簇的振动光谱复杂 ,最强的振动峰来源于质子在溶剂壳中两个氧原子之间的振动 ,而且随着团簇尺寸的增加羰基的伸缩振动峰的数目也随之增多     

工程——工程学科研究进展

本年度进行的工程设计是为保证产品在加工、装配、试验过程中能满足设计要求而进行的辅助产品的设计。开展了微细深孔钻削装置设计、装配装置设计、真空系统改进设计及振动试验夹具设计等，这些辅助产品对保证产品质量，按时地完成生产任务起到了重要作用。     

Light-Gradient-Induced Spiral Wave Drifts in a Belousov-Zhabotinsky Reaction

The dynamic behaviour of spiral tip in the light-sensitive Belousov-Zhabotinsky reaction under the influence of an externally applied light gradient was experimentally studied. The gradient causes different drifts for different spiral patterns. The centre of the spiral wave moved toward the region of lower light intensity. The direction of an additional perpendicular drift depended on the chirality of the spiral wave. The dependences of the drifting angle and the drifting velocity on light gradient have been measured.     

二阶强次线性常微分方程解的振动性

本文讨论二阶非线性常微分方程 (a(t)ψ(x(t))x’(t))’+q(t)f(x(t))g(x’(t))=0 (1)的解的振动性质。在方程(1)中,α∈C[[t_0,∞),(0,∞)],ψ∈C[R,(0,∞)](R=(-∞,+∞)),q∈C[[t_0,∞),[0,∞)]且在任意的区间(t,∞)(t≥t_0)上不恒等于0,f∈C’[R,R],g∈C[R,R]。关于微分方程振动性的定义,如通常定义,不再详述。在下面的定理中,以下条件将要用到:     

高阶非线性差分方程的振动性

本文研究了差分方程△ｄｘ（ｎ）＋ｐ（ｎ）△（ｄ－１）ｘ（ｎ）＋Ｈ（ｎ，ｘ（ｎ））＝０，（１．１）△ｄｘ（ｎ）＋ｐ（ｎ）△（ｄ－１）ｘ（ｎ，ｘ（ｎ））＝Ｑ（ｎ）．（１．２）在一定的条件下，证明了方程（１．１）与（１．２）在振动性方面的等价问题．对于方程（１．１）或（１．２），在ｎ是偶数时的每一个有界解是振动的，在ｎ是奇数时，每一个有界解是振动的或当→∞时单调趋于零的充要性定理也建立了．     

OSCILLATION OF A FORCED SECOND ORDER NONLINEAR EQUATION

ＯＳＣＩＬＬＡＴＩＯＮ ＯＦ Ａ ＦＯＲＣＥＤ ＳＥＣＯＮＤ ＯＲＤＥＲ ＮＯＮＬＩＮＥＡＲ ＥＱＵＡＴＩＯＮ ￥ＫＯＮＧＱＩＮＧＫＡＩ；ＺＨＡＮＧＢＩＮＧＧＥＮＡｂｓｔｒａｃｔ：Ｔｈｉｓｐａｐｅｒｇｉｖｅｓｓｅｖｅｒａｌｃｒｉｔｅｒｉａｏｎｔｈｅｏ...     

随机删失下乘积限过程和累积失效率过程振动模的局部渐近性

在随机删失下研究了乘积限过程和累积失效率过程的振动模的局部性质 .给出了这两个过程的振动模的重对数律 ,并应用这些结果得到了几种核密度估计和Bahadur-Kiefer过程的精确收敛速度     

电机工程中一类非线性振动方程的渐近分布

本文采用文［１］中提出的修正的Крылов－Боголюбов方法，研究电机工程中一类非线性振动方程，定量地给出了存在极限环的参数范围以及极限环的振幅，并判定该极限环是不稳定的，这些结果与已知的定性分析结果完全一致，从而进一步证实了上述渐近方法的有效性。     

Study of hot bands in the B2Σ+u-X2Σ+g system of C-2 anion

Optical heterodyne magnetic rotation enhanced velocity modulation spectroscopy was employed to observe the visible absorption spectra of the B^2Σ^+_u-X^2Σ^+_g electronic transition of C^-_2. Four hot bands (0,1), (1,2), (2,3) and (3,4) have been observed and the band (3,4) is measured directly for the first time, so far as we know, by absorption. A rotational analysis was carried out to obtain molecular constants. With the Franck－Condon principle and the vibrational Boltzmann distribution, we have estimated the vibrational temperature of C^-_2 to be about 3000K.     

Residual stress profiling of an aluminum alloy by laser ultrasonics

A residual-stress profile along the thickness of an aluminum alloy sheet is determined by laser-ultrasonic technique. Surface acoustic waves are generated by a Nd:YAG pulse laser and detected by a Heterodyne interferometer on a lateral free surface of the sheet. The distribution of residual stress is determined by measuring the relative variation of the wavevelocities at different location of the sample along its thickness. This technique is validated by three different residual stress profiles obtained experimentally.