期刊名称：Proceedings of the National Academy of Sciences
印刷版ISSN：0027-8424
电子版ISSN：1091-6490
出版年度：1976
卷号：73
期号：9
页码：2964-2965
DOI：10.1073/pnas.73.9.2964
语种：English
出版社：The National Academy of Sciences of the United States of America
摘要：The purpose of this paper has been to calculate the magnetic rotational strength of the spin-forbidden 1A1 [->] 3A2 transition of the carbonyl group. For this purpose, simple molecular orbitals have been used and only one-center integrals have been considered. The calculated results have been compared with the experimental measurements.
关键词：molecular orbitals ; carbonyl group ; one-center integrals
