铁分子Fe2的自旋极化效应

采用密度泛函方法(B3P86)对 Fe_2分子结构进行了优化.计算结果中未观察到自旋污染,基态波函数与高态波函数并未混杂,结果表明,Fe_2中有8个未配对电子,这些电子空间分布不同和自旋平行产生的自旋极化效应,使 Fe_2能量最低.计算结果表明,Fe_2分子的基态是~9∑_g~ ,并非~7Δ_u,进而表明 Fe_2的自旋平行效应比电子自旋配对效应要强.计算得到该分子基态的二阶、三阶和四阶力常数分别为1.4115×10~(-2)aJ/nm~2、-37.1751×10~3aJ/nm~3和 98.7596×10~4aJ/nm~4；光谱数据ω_eχ_e、B_e、α_e分别为0.3522、0.0345、 0.4963×10~(-4)cm~(-1)；离解能为3.5522eV,平衡键长为0.2137nm,振动频率为292.914cm~(-1)；并得到了 Murrel-Sorbie 函数.     

Organotellurides as a source of organometallics: application in the synthesis of (+/−)-frontalin

A masked lithium homoenolate, generated by tellurium/lithium exchange, was reacted with epoxides. The lithium compound was also converted into other organometallics such as Grignard, and cuprates and the reactivity of those organometallics with epoxides was evaluated. The same building block was employed in the synthesis of (+/−)-frontalin.     

The acoustic characteristics of clause, sentence and paragraph boundaries in Chinese Putonghua

The acoustic and perceptive characteristics of discourse units, including clauses, simple sentences, compound sentences and paragraphs, were studied. The acoustic characteristics were based on the analysis of a speech corpus consisted of ten monologues. The Perceived Boundary Strength (PBS) of the monologues was labeled on a five-point scale by 25 participants. The main results are as follows: (1) There is a significant difference in the PBS of clauses (corresponding to intonational phrase), sentences (including simple sentences and compound sentences) and paragraphs. But the PBS of simple sentences and compound sentences is the same, and the pitch reset and pause are also not significantly different between these two kinds of boundaries. (2) The pitch-based cue used to distinguish clauses, sentences and paragraphs appears to be the difference between pre- and post-boundary syllables, but not simply the pitch value of either syllable alone. (3) Declination mainly occurs within intonational phrases, whereas there is no consistent global declination in sentences or in paragraphs. (4) Pauses are longer and more varied at the boundary of larger discourse units. Moreover, there is a significant positive correlation between pause duration and degree of pitch reset at clause boundaries, but not at sentence or paragraph boundaries.     

Isotopic families of contact manifolds for elliptic PDE

A test for a function to be a solution of an elliptic PDE is given in terms of extensions, as solutions, from the boundaries inside the domains belonging to an isotopic family. It generalizes a result of Ehrenpreis for spheres moved along a straight line.

     

Hilbert重级数定理的一个改进

The object of this note is to prove the followingTheorem Let{a_n}and{b_n}be sequences of real numbers such that0<∑∑a_n~2<+∞and0<∑b_n~2<+∞.Then we have the inequalitysum from m=1 to∞sum from n=1 to∞a_mb_n/m+n<{sum from n=1 to∞(π-θ/n~(1/2)a_n~2}~1/2{sum from n=1 to∞(π-θ/n~(1/2)b_n~2}~1/2 (1)whereθ=3/2~(1/2)-1=1.121320343.     

Temperature dependence of corundum roentgenoluminescence and thermoluminescence

Translated from Zhurnal Prikladnoi Spektroskopii, Vol. 54, No. 3, pp. 438–444, March, 1991.     

Compact spreads and compact translation planes over locally compact fields

We prove that a spread S over a locally compact nondlscrete field F defines a topological translation plane if and only if the spread is compact. For F=R, this is implicit in Breuning's thesis [Bre], cf. [B 2]. For the proof, we describe the point set of the projective translation plane as a quotient space of some projective space, with identifications taking place in one hyperplane. This is new even for F=R.     

Kalman filtering of a space-time Markov random field

In this paper, finite-dimensional recursive filters for space-time Markov random fields are derived. These filters can be used with the expectation maximization (EM) algorithm to yield maximum likelihood estimates of the parameters of the model.