HMO导图分子片与AO系数 |
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摘 要: | 本文导出共轭分子 l 重简并()分子轨道 AO 系数与 l-1阶导图分子片对应的本征多项式间的关联公式,并用于求得()分子轨道。
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关 键 词: | 共轭分子 HMO 导图分子片 AO 系数 |
HMO Induced Subgrapp's Molecular Fragments and AO Coefficients |
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Authors: | Wang Guodong |
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Institution: | Wang Guodong |
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Abstract: | For conjugate molecules,this paper has induced a correlated formula for the AO coefficients of π-MO whose degeneracy is l and the (l-1)-order induced subgraph's molecular fragments,by means of which π-MO of the conjugate molecule can be obtained. |
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Keywords: | Conjugate molecule HMO Induced subgraph's molecular fragment AO coefficient |
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