Application of General-order Relativistic Coupled-cluster Theory to Estimate Electric-field Response Clock Properties of Ca$^+$ and Yb$^+$

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Main Authors: Yu, YanMei, Sahoo, B. K.
Format: Preprint
Published: 2025
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author Yu, YanMei
Sahoo, B. K.
author_facet Yu, YanMei
Sahoo, B. K.
contents Accurate calculations of electric dipole polarizabilities ($α_d$), quadrupole moments ($Θ$), and quadrupole polarizabilities ($α_q$) for the clock states of the singly charged calcium (Ca$^+$) and ytterbium (Yb$^+$) ions are presented using the general-order relativistic coupled-cluster (RCC) theory. Precise knowledge of these quantities is immensely useful for estimating uncertainties caused by major systematic effects such as the linear and quadratic Stark shifts and black-body radiation shifts in the optical Ca$^+$ and Yb$^+$ clocks. A finite-field approach is adopted for estimating these quantities, in which the first-order and second-order energy level shifts are analyzed by varying strengths of externally applied electric field and field-gradient. To achieve high-accuracy results in the heavier Yb$^+$ ion, we first calculate these properties in a relatively lighter clock candidate, Ca$^+$, which involves similar clock states. From these analyses, we learned that electron correlation effects arising from triple excitations in the RCC theory contribute significantly to the above properties, and are decisive factors in bringing the calculated values closer to the experimental results.
format Preprint
id arxiv_https___arxiv_org_abs_2502_06225
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Application of General-order Relativistic Coupled-cluster Theory to Estimate Electric-field Response Clock Properties of Ca$^+$ and Yb$^+$
Yu, YanMei
Sahoo, B. K.
Atomic Physics
Accurate calculations of electric dipole polarizabilities ($α_d$), quadrupole moments ($Θ$), and quadrupole polarizabilities ($α_q$) for the clock states of the singly charged calcium (Ca$^+$) and ytterbium (Yb$^+$) ions are presented using the general-order relativistic coupled-cluster (RCC) theory. Precise knowledge of these quantities is immensely useful for estimating uncertainties caused by major systematic effects such as the linear and quadratic Stark shifts and black-body radiation shifts in the optical Ca$^+$ and Yb$^+$ clocks. A finite-field approach is adopted for estimating these quantities, in which the first-order and second-order energy level shifts are analyzed by varying strengths of externally applied electric field and field-gradient. To achieve high-accuracy results in the heavier Yb$^+$ ion, we first calculate these properties in a relatively lighter clock candidate, Ca$^+$, which involves similar clock states. From these analyses, we learned that electron correlation effects arising from triple excitations in the RCC theory contribute significantly to the above properties, and are decisive factors in bringing the calculated values closer to the experimental results.
title Application of General-order Relativistic Coupled-cluster Theory to Estimate Electric-field Response Clock Properties of Ca$^+$ and Yb$^+$
topic Atomic Physics
url https://arxiv.org/abs/2502.06225