Different flavors of nonadiabatic molecular dynamics-Reference-Cited by-同舟云学术

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Different flavors of nonadiabatic molecular dynamics

Published:2019-04-24 Issue:5 Volume:9 Page:
ISSN:1759-0876
Container-title:WIREs Computational Molecular Science
language:en
Short-container-title:WIREs Comput Mol Sci

Author:

Agostini Federica¹,Curchod Basile F. E.²^ORCID

Affiliation:

1. Laboratoire de Chimie Physique UMR 8000 CNRS/University Paris‐Sud Orsay France

2. Department of Chemistry Durham University Durham UK

Funder

Durham University

Publisher

Wiley

Subject

Materials Chemistry,Computational Mathematics,Physical and Theoretical Chemistry,Computer Science Applications,Biochemistry

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/wcms.1417

Reference166 articles.

1. Perspective on “Zur Quantentheorie der Molekeln”;Tully JC;Theor Chem Acc.,2000

2. Electron–vibration entanglement in the Born–Oppenheimer description of chemical reactions and spectroscopy

3. Non-adiabatic effects in thermochemistry, spectroscopy and kinetics: the general importance of all three Born–Oppenheimer breakdown corrections

4. Signatures of a Conical Intersection in Adiabatic Dissociation on the Ground Electronic State

5. Nonadiabatic effects on the charge transfer rate constant: A numerical study of a simple model system

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