Theoretical study of the transition dipole moments, spin-orbit and L-uncoupling functions of the LiCs molecule

Ekaterina A. Bormotova; Andrey V. Stolyarov

doi:10.1039/d5cp02805a

January 1, 2025Physical Chemistry Chemical Physics

Theoretical study of the transition dipole moments, spin-orbit and L-uncoupling functions of the LiCs molecule

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Key Points

Evaluated spin-orbit coupling for the LiCs molecule over a range of internuclear distances.
Key findings provide insight into electronic states and potential transitions in the molecule.
Assessment using theoretical models across a spectrum of internuclear distances was conducted.
Findings highlight the importance of understanding molecular interactions in theoretical chemistry.

Implication

Theoretical analysis reveals spin-orbit coupling in LiCs, suggesting implications for electronic state transitions.

Abstract

Transition dipole moments as well as spin-orbit coupling and L-uncoupling matrix elements were evaluated for the LiCs molecule in a wide range of internuclear distances, R, for all electronic states...

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Cite This Study

Bormotova et al. (2025) studied this question.

synapsesocial.com/papers/693231368e51979591dcea34 https://doi.org/10.1039/d5cp02805a

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Theoretical study of the transition dipole moments, spin-orbit and L-uncoupling functions of the LiCs molecule

Key Points

Implication

Abstract

Discussion

Cite This Study

Theoretical study of the transition dipole moments, spin-orbit and L-uncoupling functions of the LiCs molecule

Key Points

Implication

Abstract

Discussion

Cite This Study

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