From adiabatic to diabatic representation: an ab initio investigation of the LiS molecule

Physical Chemistry Chemical Physics 2026

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Authors: Sana Akkari, zrafi wissem, Mohamed Bejaoui, Hela Ladjimi, Jamila Dhiflaoui, J. E. Sienkiewicz, Hamid Berriche
DOI: 10.1039/d5cp04173b
Cited by: 1
References: 62

Abstract

Π states. This work advanced the theoretical framework for modeling diatomic systems in which nonadiabatic effects may be significant, with implications for precision spectroscopy and molecular dynamics.

Fields of Study & Subjects

Advanced Chemical Physics Studies Advanced Physical and Chemical Molecular Interactions Atomic and Molecular Physics

Publication details

Journal / source
Physical Chemistry Chemical Physics
Publisher
Royal Society of Chemistry (RSC)
Volume
28
Issue
7
Pages
4790–4805
Publication date
1 January 2026
Language
EN