Fine structure investigation and laser cooling study of the LaH molecule

A theoretical feasibility study of the spin-orbit laser cooling of the molecule LaH has been performed based on a complete active space self-consistent field (CASSCF)/MRCI <i>ab initio</i> calculation with Davidson correction in the <i>Λ</i> <sup>(±)</sup> and <i>Ω</i> <sup>(±)</sup> representations. The adiabatic potential energy curves and spectroscopic constants have been investigated for the considered electronic states. The small value of the equilibrium positions difference Δ<i>R</i> <sub>e</sub> between the ground and the electronic states <i>X</i> <sup>3</sup> <i>Σ</i> <sub>0+</sub>, (1)<sup>3</sup> <i>Π</i> <sub>0+</sub>, and (1)<sup>3</sup> <i>Δ</i> <sub>1</sub> predicts the candidacy of the molecule LaH for direct laser cooling between the first two states with the intermediate state (1)<sup>3</sup> <i>Δ</i> <sub>1</sub>. The calculation of the diagonal Franck-Condon factors, the short radiative lifetime, and the experimental parameters (slowing distance, Doppler and recoil temperature, …) suggest that the molecule LaH is a good candidate for Doppler laser cooling, and a corresponding laser cooling scheme is presented.

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Publication Details

Journal
RSC Advances
Published
2025-01-01
DOI
https://doi.org/10.1039/d5ra02708j
Primary Topic
Optical properties and cooling technologies in crystalline materials
Type
article
Field-Weighted Citation Impact
0.00

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article

Fine structure investigation and laser cooling study of the LaH molecule

Nayla El‐Kork, Nissrin Alharzali, Nariman Abu el kher, Mahmoud Korek et al.
RSC Advances
Optical properties and cooling technologies in crystalline materials
article

Fine structure investigation and laser cooling study of the LaH molecule

Nayla El‐Kork, Nissrin Alharzali, Nariman Abu el kher, Mahmoud Korek, Joumana Assaf
article en

Abstract

A theoretical feasibility study of the spin-orbit laser cooling of the molecule LaH has been performed based on a complete active space self-consistent field (CASSCF)/MRCI <i>ab initio</i> calculation with Davidson correction in the <i>Λ</i> <sup>(±)</sup> and <i>Ω</i> <sup>(±)</sup> representations. The adiabatic potential energy curves and spectroscopic constants have been investigated for the considered electronic states. The small value of the equilibrium positions difference Δ<i>R</i> <sub>e</sub> between the ground and the electronic states <i>X</i> <sup>3</sup> <i>Σ</i> <sub>0+</sub>, (1)<sup>3</sup> <i>Π</i> <sub>0+</sub>, and (1)<sup>3</sup> <i>Δ</i> <sub>1</sub> predicts the candidacy of the molecule LaH for direct laser cooling between the first two states with the intermediate state (1)<sup>3</sup> <i>Δ</i> <sub>1</sub>. The calculation of the diagonal Franck-Condon factors, the short radiative lifetime, and the experimental parameters (slowing distance, Doppler and recoil temperature, …) suggest that the molecule LaH is a good candidate for Doppler laser cooling, and a corresponding laser cooling scheme is presented.

RSC AdvancesVol. 15(49)
Lebanese University (LB), Khalifa University of Science and Technology (AE), Beirut Arab University (LB), National Council for Scientific Research (LB)
Khalifa University of Science, Technology and Research, Department of Education and Knowledge
Openalex Percentile: Top 75%
Optical properties and cooling technologies in crystalline materials
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Fine structure investigation and laser cooling study of the LaH molecule — Nayla El‐Kork, Nissrin Alharzali, et al. · RSC Advances (2025) | TGRS Research Map | TGRS