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Neglected Importance of Anharmonicity in Quantifying the Renner–Teller Effect

[Image: see text] Linear molecules in degenerate electronic states are influenced by the Renner–Teller (RT) effect. Currently the formula to quantify this vibronic interaction only considers the harmonic term. However, such a harmonic formula cannot well describe molecules that have double-well pote...

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Detalles Bibliográficos
Autor principal: Lu, Qing
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9730495/
https://www.ncbi.nlm.nih.gov/pubmed/36506164
http://dx.doi.org/10.1021/acsomega.2c05494