Intramolecular Quantum Dynamics On Intersecting Potential Energy Surfaces: A Tutorial Review

Abstract

Vibronic coupling-i.e. the interaction between molecular electronic states through the nuclear motion- is an ubiquitous phenomenon for molecular electronic spectra and dynamics in excited electronic states. While the Born-Oppenheimer or adiabatic separation of electronic and nuclear motions remains the cornerstone of our thinking in the field, the ensuing limitations are often thought of almost in line with the theorem itself. In this short review paper, we attempt to give a lucid overview over some basics in the field complemented by relevant examples. While written from a personal perspective, it is nevertheless hoped to provide some useful insight for the beginner and expert alike.

Article information

Article type
Tutorial Review
Submitted
22 Dec 2025
Accepted
04 Mar 2026
First published
18 Mar 2026
This article is Open Access
Creative Commons BY license

Phys. Chem. Chem. Phys., 2026, Accepted Manuscript

Intramolecular Quantum Dynamics On Intersecting Potential Energy Surfaces: A Tutorial Review

H. Koeppel and B. Nikoobakht, Phys. Chem. Chem. Phys., 2026, Accepted Manuscript , DOI: 10.1039/D5CP04985G

This article is licensed under a Creative Commons Attribution 3.0 Unported Licence. You can use material from this article in other publications without requesting further permissions from the RSC, provided that the correct acknowledgement is given.

Read more about how to correctly acknowledge RSC content.

Social activity

Spotlight

Advertisements