量子化的

With the use of linear-combination operator and unitary transformation method,the influence of the dispersion of phonons on the properties of weak-coupling magnetopolaron in a parabolic quantum dot is studied.

利用线性组合算符和幺正变换的方法，研究声子色散对磁场中抛物量子点弱耦合磁极化子性质的影响。

Quantum chemical and molecular mechanical methods were employed to study the acylation in the acetylthiocholine hydrolysis catalyzed by acetylcholinesterase.

应用量子化学和分子力学方法研究乙酰胆碱酯酶催化硫代乙酰胆碱水解反应中的乙酰化反应，计算了反应物、过渡态、产物及中间体的几何结构及电子结构。

Molecular geometry,atomic net charge,constituents and energy of the frontier molecular orbital for eight alkylated arylamine anti-oxidant and anti-corrosive additive s have been calculated by density functional theoryat the 6-31G~* basis set level.

采用量子化学方法，在B3LYP/6-31G~*水平上对8种烷基化芳胺抗氧抗腐添加剂的平衡几何构型、净电荷及前线轨道组成和能级等进行了理论计算研究，探讨了这些化合物的结构特征。

Theoretical studies on various geometrical structures of Hypophosphorous acid were carried out using DFT theoretical methods,at the B3LYP/6—311++G** level.Intramolecular proton transfer isomerization has also been studied using the intrinsic reaction coordinate.

采用量子化学密度泛函B3LYP方法，在6—311++G**基组水平上全优化得到了硫代次磷酸的硫酮式和硫醇式两种构型异构体以及相应的对映异构体，同时对分子内质子转移异构化反应微观机理进行了理论分析。

Theoretical studies on various geometrical structures of Hypophosphorous acid were carried out using DFT theoretical methods, at the B3LYP/6-311 ++ G(superscript **) level. Intramolecular proton transfer isomerization has also been studied using the intrinsic reaction coordinate.

采用量子化学密度泛函B3LYP方法，在6-311++G基组水平上全优化得到了硫代次磷酸的硫酮式和硫醇式两种构型异构体以及相应的对映异构体，同时对分子内质子转移异构化反应微观机理进行了理论分析。

It is the first time to study the fluctuation of quantum well width and the influence of exciton localization, arising from the fluctuation, on exciton recombination.

这是首次从理论上探讨了量子阱阱宽涨落及其所引起的激子定域化对激子复合行为的影响。

Numerical results indicate that the mean number of phonons for strong-coupling magnetopolaron will decrease with increasing temperature.

数值结果表明，非对称量子点中强耦合磁极化子的声子平均数随温度的升高而减小。

Temperature dependence of the the vibration frequency and the mean number of phonons for weak-coupling magnetopolaron in an asymmetric quantum dot were studied by using Huybrechts linear combination operator and Lee-Low-Pines variation method.

采用Huybrechts线性组合算符法和Lee-Low-Pines幺正变换法，研究了非对称抛物量子点内弱耦合磁极化子的振动频率和声子平均数的温度依赖性。

It could give existing forms of compact memory a serious run for their money—and instead of being a curse of miniaturisation, quantum physics might turn out to be a blessing in disguise.

如果他们的科学发现能够被商业化，那么它就会让现存的紧凑存储器厂商们大伤元气；因此量子物理就不会是微型化理论所趋，而最终这将是塞翁失马–因祸得福了。

If their discovery can be commercialised it could give existing forms of compact memory a serious run for their money—and instead of being a curse of miniaturisation, quantum physics might turn out to be a blessing in disguise.

如果他们的科学发现能够被商业化，那么它就会让现存的紧凑存储器厂商们大伤元气；因此量子物理就不会是微型化理论所趋，而最终这将是塞翁失马–因祸得福了。

On the other hand, the more important thing is because the urban housing is a kind of heterogeneity products.

另一方面，更重要的是由于城市住房是一种异质性产品。

Climate histogram is the fall that collects place measure calm value, cent serves as cross axle for a few equal interval, the area that the frequency that the value appears according to place is accumulated and becomes will be determined inside each interval, discharge the graph that rise with post, also be called histogram.

气候直方图是将所收集的降水量测定值，分为几个相等的区间作为横轴，并将各区间内所测定值依所出现的次数累积而成的面积，用柱子排起来的图形，也叫做柱状图。