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本文对我们早些时候提出的关于轨道对称性匹配与否的判据,做了进一步的补充说明,并将其在各种双原子分子坐标选择中的具体使用方法和结果造了表。
This paper gives a further supplement to the criteria we proposed earlier on whether orbital symmetry matches, and makes a table of how to use them in various diatomic molecular coordinates selection.