Document Type
Conference Proceeding
Publication Date
6-11-2020
Publication Title
Journal of Physics: Conference Series
Volume
1412
First page number:
1
Last page number:
1
Abstract
We report non-adiabatic dynamics of the Li+LiNa→Li2+Na chemical reaction at cold and ultracold temperatures employing accurate ab initio electronic potential energy surfaces in a quantum dynamics formulation employing a diabatic representation. Results are compared against those from a single adiabatic ground state potential energy surface and a universal model based on the long-range interaction potential. We discuss signatures of non-universal behavior in the total rate coefficients as well as strong non-adiabatic effects in the state-to-state rotationally resolved rate coefficients.
Disciplines
Biological and Chemical Physics | Quantum Physics
File Format
File Size
264 KB
Language
English
Creative Commons License
This work is licensed under a Creative Commons Attribution 4.0 License.
Repository Citation
Kendrick, B. K.,
Li, M.,
Li, H.,
Kotochigova, S.,
Croft, J. F.,
Naduvalath, B.
(2020).
Non-Adiabatic Quantum Dynamics of the Ultracold Li+LiNa→ Li2+Na Chemical Reaction.
Journal of Physics: Conference Series, 1412
1-1.
http://dx.doi.org/10.1088/1742-6596/1412/12/122016
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