作者: Jens Peder Dahl , Xuejun Feng
DOI: 10.1007/BF00549674
关键词:
摘要: The electronic states of one-electron diatomic molecules possess two types symmetry, geometrical and dynamical. latter is in general ignored when the LCAO description adapted. We demonstrate how it can be included, its inclusion modifies ordinary regions where same symmetry cross.