Electronic Structures and Transition Properties of BeSe and BeTe Molecules

[Image: see text] The electronic structure of BeSe and BeTe molecules has been investigated using the ab initio CASSCF/(MRCI + Q) method at the spin-free and spin-orbit level. The potential energy curves, the permanent dipole moment, the spectroscopic constants T(e), R(e), ω(e), and B(e), and the di...

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Detalles Bibliográficos
Autores principales: Zeid, Israa, El-Kork, Nayla, Farjallah, Mohamed, Ladjimi, Hela, Berriche, Hamid, Korek, Mahmoud
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8603188/
https://www.ncbi.nlm.nih.gov/pubmed/34805665
http://dx.doi.org/10.1021/acsomega.1c03170

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8603188/
https://www.ncbi.nlm.nih.gov/pubmed/34805665
http://dx.doi.org/10.1021/acsomega.1c03170

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