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1·This paper suggests frontier orbital energies as criterion of the dynamic stability.

本文建议用前线分子轨道能量作为分子动力学稳定性判据。

2·Based on the frontier orbital characters and charge distributions the electronic structures of these compounds are discussed.

从前线轨道特征、电荷分布等与自由卟啉对比讨论了杂原子取代卟啉的电子结构。

3·Between electron density distribution of molecular frontier orbital energy and the substitute position, there were some dependencies.

发现前线轨道能量与分子的电子密度分布及取代位置均有一定依赖关系。

4·The active atoms and bonds of reaction were provided by frontier molecular orbital theory.

用前线分子轨道理论分析了反应的活性原子和活性键。

5·The result is explained qualitatively with the theory of frontier molecular orbital.

根据前线分子轨道理论，对实验结果提出了定性的解释。

6·As a newly emerging frontier branch of science, the science of orbital diseases has made significant progress in the last few years.

眼眶病学作为一门新兴的边缘学科，近几年的研究进展很快。