2024
DOI: 10.26434/chemrxiv-2024-n6cbn
|View full text |Cite
Preprint
|
Sign up to set email alerts
|

Simulations of photoinduced processes with the exact factorization: State of the art and perspectives

Lea Maria Ibele,
Eduarda Sangiogo Gil,
Evaristo Villaseco Arribas
et al.

Abstract: This Perspective offers an overview on the applications of the exact factorization of the electron-nuclear wavefunction to the domain of theoretical photochemistry, where the aim is to gain insights into the ultrafast dynamics of molecular systems via simulations of their excited-state dynamics beyond the Born-Oppenheimer approximation. The exact fac- torization offers an alternative viewpoint to the Born-Huang representation for the interpretation of dynamical processes involving the electronic ground and exc… Show more

Help me understand this report

Search citation statements

Order By: Relevance

Paper Sections

Select...

Citation Types

0
0
0

Publication Types

Select...

Relationship

0
0

Authors

Journals

citations
Cited by 0 publications
references
References 235 publications
0
0
0
Order By: Relevance

No citations

Set email alert for when this publication receives citations?