Variational calculation of the hyperfine Stark effect in atomic <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"> <mml:mrow> <mml:mmultiscripts> <mml:mi>Rb</mml:mi> <mml:mprescripts/> <mml:none/> <mml:mn>87</mml:mn> </mml:mmultiscripts> <mml:

An electronically variational approach to the calculation of atomic hyperfine structure transition energies under the influence of static external electric fields is presented. The method avoids the calculation of intermediate atomic states entirely and requires only the wave functions of the electronic states involved in the respective hyperfine levels. These wave functions are obtained through relativistic general-excitation-rank configuration-interaction theory. A variant of the method also enables calculations on atoms with the most complicated of shell structures. Applications to $^{87}\mathrm{Rb}, ^{133}\mathrm{Cs}$, and a specific clock transition in $^{169}\mathrm{Tm}$ are presented. The final results ${k}_{\text{Rb}}=\ensuremath{-}1.234\ifmmode\pm\else\textpm\fi{}0.023\phantom{\rule{0.28em}{0ex}}[{10}^{\ensuremath{-}10}\phantom{\rule{0.28em}{0ex}}\mathrm{Hz}/{(\mathrm{V}/\mathrm{m})}^{2}]$ and ${k}_{\text{Cs}}=\ensuremath{-}2.347\ifmmode\pm\else\textpm\fi{}0.084\phantom{\rule{0.28em}{0ex}}[{10}^{\ensuremath{-}10}\phantom{\rule{0.28em}{0ex}}\mathrm{Hz}/{(\mathrm{V}/\mathrm{m})}^{2}]$ obtained under inclusion of up to quintuple excitations in the atomic wave-function expansion are compatible with previous calculations and, in the case of Cs, confirm that one of the earlier experimental measurements is not reliable. For $^{169}\mathrm{Tm}$ that is used in the development of atomic clocks the differential static scalar electric dipole polarizability between ground levels $J=\frac{7}{2}$ and $\frac{5}{2}$ is calculated to be $\mathrm{\ensuremath{\Delta}}{\ensuremath{\alpha}}_{0}^{s}=\ensuremath{-}0.134\ifmmode\pm\else\textpm\fi{}0.122$ a.u. This result from a pure ab initio calculation supports the result of $\mathrm{\ensuremath{\Delta}}{\ensuremath{\alpha}}_{0}^{s}=\ensuremath{-}0.{063}_{\ensuremath{-}0.005}^{+0.01}$ a.u. obtained recently [A. Golovizin, E. Fedorova, D. Tregubov, D. Sukachev, K. Khabarova, V. Sorokin, and N. Kolachevsky, Nat. Commun. 10, 1724 (2019)] where a combination of measurement and theoretical modeling has been used.

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Journal
Physical review. A/Physical review, A
Published
2025-10-08
DOI
https://doi.org/10.1103/cy87-s81k
Primary Topic
Advanced Frequency and Time Standards
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article
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Variational calculation of the hyperfine Stark effect in atomic <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"> <mml:mrow> <mml:mmultiscripts> <mml:mi>Rb</mml:mi> <mml:mprescripts/> <mml:none/> <mml:mn>87</mml:mn> </mml:mmultiscripts> <mml:

Timo Fleig
Physical review. A/Physical review, A
Advanced Frequency and Time Standards
article

Variational calculation of the hyperfine Stark effect in atomic <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"> <mml:mrow> <mml:mmultiscripts> <mml:mi>Rb</mml:mi> <mml:mprescripts/> <mml:none/> <mml:mn>87</mml:mn> </mml:mmultiscripts> <mml:

Timo Fleig
article en

Abstract

An electronically variational approach to the calculation of atomic hyperfine structure transition energies under the influence of static external electric fields is presented. The method avoids the calculation of intermediate atomic states entirely and requires only the wave functions of the electronic states involved in the respective hyperfine levels. These wave functions are obtained through relativistic general-excitation-rank configuration-interaction theory. A variant of the method also enables calculations on atoms with the most complicated of shell structures. Applications to $^{87}\mathrm{Rb}, ^{133}\mathrm{Cs}$, and a specific clock transition in $^{169}\mathrm{Tm}$ are presented. The final results ${k}_{\text{Rb}}=\ensuremath{-}1.234\ifmmode\pm\else\textpm\fi{}0.023\phantom{\rule{0.28em}{0ex}}[{10}^{\ensuremath{-}10}\phantom{\rule{0.28em}{0ex}}\mathrm{Hz}/{(\mathrm{V}/\mathrm{m})}^{2}]$ and ${k}_{\text{Cs}}=\ensuremath{-}2.347\ifmmode\pm\else\textpm\fi{}0.084\phantom{\rule{0.28em}{0ex}}[{10}^{\ensuremath{-}10}\phantom{\rule{0.28em}{0ex}}\mathrm{Hz}/{(\mathrm{V}/\mathrm{m})}^{2}]$ obtained under inclusion of up to quintuple excitations in the atomic wave-function expansion are compatible with previous calculations and, in the case of Cs, confirm that one of the earlier experimental measurements is not reliable. For $^{169}\mathrm{Tm}$ that is used in the development of atomic clocks the differential static scalar electric dipole polarizability between ground levels $J=\frac{7}{2}$ and $\frac{5}{2}$ is calculated to be $\mathrm{\ensuremath{\Delta}}{\ensuremath{\alpha}}_{0}^{s}=\ensuremath{-}0.134\ifmmode\pm\else\textpm\fi{}0.122$ a.u. This result from a pure ab initio calculation supports the result of $\mathrm{\ensuremath{\Delta}}{\ensuremath{\alpha}}_{0}^{s}=\ensuremath{-}0.{063}_{\ensuremath{-}0.005}^{+0.01}$ a.u. obtained recently [A. Golovizin, E. Fedorova, D. Tregubov, D. Sukachev, K. Khabarova, V. Sorokin, and N. Kolachevsky, Nat. Commun. 10, 1724 (2019)] where a combination of measurement and theoretical modeling has been used.

Physical review. A/Physical review, AVol. 112(5)
Fermi National Accelerator Laboratory (US), Université Fédérale de Toulouse Midi-Pyrénées (FR), Laboratoire de Chimie et Physique Quantiques (FR)
Openalex Percentile: Top 74%
Advanced Frequency and Time Standards
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