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Cold reactive and non-reactive collisions of Li and Rb with C2^-: implications for hybrid trap experiments

arXiv
Authors: Milaim Kas, Jérôme Loreau, Jacques Liévin, Nathalie Vaeck

Year

2018

Paper ID

24231

Status

Preprint

Abstract Read

~2 min

Abstract Words

161

Citations

N/A

Abstract

We present a theoretical investigation of cold reactive and non-reactive collisions of Li and Rb atoms with C2-. The potential energy surfaces for the singlet and triplet states of the Li--C2- and Rb--C2- systems have been obtained using the CASSCF/ic-MRCI+Q approach with extended basis sets. The potential energy surfaces are then used to investigate the associative detachment reaction and to calculate rotationally inelastic cross sections by means of the close-coupling method. The effect of the core correlation on the potential energy surfaces is discussed and we estimate the error on the collisional cross sections induced by freezing the 1s orbitals of the carbon atoms. The results are compared to those obtained for the Rb-OH- system and the applications for hybrid trap experiments are explored. Furthermore, we discuss the possibility to perform Doppler thermometry on the C2- anion and investigate the collision process involving excited states. The implications for sympathetic cooling experiments are also discussed.

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  • This paper contributes to the Quantum Chemistry research area in the Quantum Articles archive.
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  • We present a theoretical investigation of cold reactive and non-reactive collisions of Li and Rb atoms with C2^-.

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