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Theoretical calculation of spectroscopy properties of selenium bromide cation

In this paper, the potential energy curves of 22 Λ–S states as well as 51 Ω states were calculated using the internally contracted multiconfiguration interaction and Davidson correction method. Through the obtained transition data, the spectroscopy data of the low excitation bound state are fitted a...

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Detalles Bibliográficos
Autores principales: Wan, Ming-jie, Wang, Guo-sen, Huang, Xing-yong, Huang, Duo-hui, Wei, Kang-lin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9703031/
https://www.ncbi.nlm.nih.gov/pubmed/36505708
http://dx.doi.org/10.1039/d2ra06580k