双原子分子

Since the High-Lying Vibrational excited levels and dissociate behavior of gas diatomic molecules: H2, O2, N2 and CO are very important in actual studies and applications, using the algebra method and the algebra energy method to obtained full vibrational energy spectra {E} and molecular dissociation energies are base on limited experiment energy level {E} in this paper. The study result has provided the important high vibrational excited state energy level and the reliable dissociation energy data for the research partial dissociating gas physics and the chemical property.

鉴于气体双原子分子H2、O2、N2和CO的高振动激发态能级和离解行为在实际研究中的重要性，本文应用代数方法和代数能量方法，以部分气体双原子分子有限的实验能级［E］为基础，获得了H2-X1Σ、O2-A^3Σ、O2-c1Σ、N2-X1Σ和CO-X^1Σ共5个电子态的完全振动能谱｛E｝及其分子的离解能，为研究部分离解气体的物理和化学性质提供了重要的高振动激发态能级和可幸的离解能数据。

The close coupling calculation of rotationally inelastic collision of He with Na_ 2 is first performed by employing a recently computed ab initio potential energy surface.

在已经拟合好的He-Na2体系势能面上，根据原子-双原子分子的非反应性碰撞动力学的相关基本理论，在空间固定坐标系下，采用严格的密耦方法求解了He原子和Na2分子的转动非弹性碰撞动力学方程。

The conventional calculation models of electron displacement polarizability are summarized and their limitations are revealed.

分析了经典的电子位移极化率的计算模型，指出了这些经典模型在计算非对称双原子分子模型时存在局限性，提出了一种针对非对称双原子分子的电子位移极化率的计算模型。

The treatment of heteronuclear diatomic molecules by LCAO-MO theory is not fundamentally different from the treatment of homonuclear diatomic s.

用LCAO-MO理论处理异核双原子分子基本上与处理同核双原子分子是相同的。

The treatment of heteronuclear diatomic molecules by LCAO -MO theory is not fundamentally different from the treatment of homonuclear diatomics.

用LCAO-MO理论处理异核双原子分子基本上与处理同核双原子分子是相同的。

The AM method and the new formula are applied to study the full vibrational energy spectra and molecular dissociation energies of some electronic states of some homonuclear and heteronuclear diatomic molecules and some diatomic ions.

然后应用AM方法和离解能新公式对一批同核和异核双原子分子，以及双原子分子离子电子态的完全振动能谱和离解能进行了研究。

The study of diatomic molecular potential energy function is the basic problem because diatomic potentials depend on only a single variable, the interatomic distance.

由于双原子分子的势能仅是原子核间距的函数，因此双原子分子势能函数是势能函数研究的基础问题。

Studies show that the AM method and the new analytical expression are reliable and economical physical methods for studying full vibrational energy spectra and molecular dissociation energies of diatomic electronic systems theoretically, which are particularly useful for those diatomic systems whose high-lying vibrational energies may not be available.

结果表明，AM方法和新建立的离解能解析式相结合的理论方法对研究双原子分子及离子的完全振动能谱和离解能是行之有效的、简单经济的物理方法，为实验技术难以精确测量其高激发振动能级或离解能的双原子分子或离子体系提供了获得精确的完全振动能谱和体系离解能的一种理论新方法。

Some representative atoms and molecules are selected to study the kinetic behavior of adsorption and diffusion on the flat and defective surfaces by employing five-parameter Morse potential and improved extended LEPS potential in this dissertation.

本论文选取了一些具有典型意义的原子和双原子分子通过5-参数Morse 势和改进推广的LEPS 势方法研究了原子、分子在过渡金属平坦和缺陷表面的吸附扩散的动力学行为。

A number of v=0~57 vibration levels were determined and assigned. The levels cover more than 99% of the potential well depth of the state. No evident autoionization was found related to the levels belonging to the 13 g- state above the ionization threshold, implying the distinct character of the doubly excited valence state from the Rydberg states.

并发现13 g-态能级即使超过电离限时亦无明显的自电离倾向，反映了双电子激发态不同于里德堡态的独特性质。13 g-态是碱金属双原子分子电离限以下唯一的3 g-对称性的态和电离限下唯一较纯的双电子激发态，这些结果为分子结构和量子化学的定量研究提供了重要的信息；（2）通过检测Na 3d 3p原子荧光，观察到Na2分子的33 g和43 g+态在3s+3d解离限以上的预解离能级及其转动线宽加宽等。

For a big chunk of credit-card losses; the number of filings (and thus charge-off rates) would be rising again, whether

年美国个人破产法的一个改动使得破产登记急速下降，而后引起了信用卡大规模的亏损。

Eph. 4:23 And that you be renewed in the spirit of your mind

弗四23 而在你们心思的灵里得以更新