The ground state hyperfine splitting values of high Z hydrogenlike ions are calculated. The relativistic, nuclear and QED corrections are taken into account. The nuclear magnetization distribution correction (the Bohr-Weisskopf effect) is evaluated within the single particle model with the g_{S}-factor chosen to yield the observed nuclear moment. An additional contribution caused by the nuclear spin-orbit interaction is included in the calculation of the Bohr-Weisskopf effect. It is found that the theoretical value of the wavelength of the transition between the hyperfine splitting components in ^{165}Ho^{66+} is in good agreement with experiment.
The one-loop self-energy correction to the hyperfine structure splitting of the 1s and 2s states of hydrogenlike ions is calculated both for the point and finite nucleus. The results of the calculation are combined with other corrections to find the ground state hyperfine splitting in lithiumlike ^{209}Bi^{80+} and ^{165}Ho^{64+}.
The angular and polarization properties of the photon pair emitted in the two--photon decay of $2s$ hyperfine states in hydrogenlike ions are investigated within the relativistic Dirac framework and second order perturbation theory. The studied transitions are $2s_{1/2}\,(F=1,0)\to1s_{1/2}\,(F=1,0)$ in Hydrogen atom and $2s_{1/2}\,(F=4,3)\to1s_{1/2}\,(F=4,3)$ in hydrogenlike Uranium ion. Two different emission patterns are found: For non-spin-flip transitions, the angular correlation ($i.e.$ the angular distribution of the emitted photons) is of the type $\sim 1+\cos^2θ$, while the linear pola…
The fully relativistic theory of the Zeeman splitting of the $1s$ hyperfine structure levels in hydrogenlike ions is considered for the magnetic field magnitude in the range from 1 to 10 T. The second-order corrections to the Breit -- Rabi formula are calculated and discussed. The results can be used for a precise determination of nuclear magnetic moments from $g$ factor experiments.
The influence of nuclear polarization on the bound-electron $g$ factor in heavy hydrogenlike ions is investigated. Numerical calculations are performed for the K- and L-shell electrons taking into account the dominant virtual nuclear excitations. This determines the ultimate limit for tests of QED utilizing measurements of the bound-electron $g$ factor in highly charged ions.
Relativistic formulas for the electric quadrupole moment of a hydrogenlike atom, induced by the hyperfine interaction, are derived for $ns_{1/2}$ and $np_{1/2}$ states. Both the magnetic dipole and electric quadrupole hyperfine interactions are taken into account. The formulas are valid for ions with arbitrary nuclear charge and spin. The induced quadrupole moment is compared with the nuclear quadrupole moment for a wide range of hydrogenlike ions.
Complete vacuum polarization calculations incorporating finite nuclear size are presented for hydrogenic ions with principal quantum numbers n=1-5. Lithiumlike, sodiumlike, and copperlike ions are also treated starting with Kohn-Sham potentials, and including first-order screening corrections. In both cases dominant Uehling terms are calculated with high accuracy, and smaller Wichmann- Kroll terms are obtained using numerical electron Green's functions.
In this paper we study the influence of electron screening on the Bohr-Weisskopf (BW) effect in many-electron atoms. The BW effect gives the finite-nucleus magnetization contribution to the hyperfine structure. Relativistic atomic many-body calculations are performed for s and p_1/2 states of several systems of interest for studies of atomic parity violation and time-reversal-violating electric dipole moments -- Rb, Cs, Fr, Ba+, Ra+, and Tl. For s states, electron screening effects are small, and the relative BW correction for hydrogenlike ions and neutral atoms is approximately the same. We r…
We describe a nonperturbative (in Zalpha) numerical evaluation of the one-photon electron self energy for 3P_{1/2}, 3P_{3/2}, 4P_{1/2} and 4P_{3/2} states in hydrogenlike atomic systems with charge numbers Z=1 to 5. The numerical results are found to be in agreement with known terms in the expansion of the self energy in powers of Zalpha and lead to improved theoretical predictions for the self-energy shift of these states.
The hyperfine structure (HFS) of a bound electron is modified by the self-interaction of the electron with its own radiation field. This effect is known as the self-energy correction. In this work, we discuss the evaluation of higher-order self-energy corrections to the HFS of bound P states. These are expressed in a semi-analytic expansion involving powers of Zalpha and ln(Zalpha), where Z is the nuclear charge number and alpha is the fine-structure constant. We find that the correction of relative order alpha (Zalpha)^2 involves only a single logarithm ln(Zalpha) for P_1/2 states [but no ter…
The nuclear shape correction to the g factor of a bound electron in 1S-state is calculated for a number of nuclei in the range of charge numbers from Z=6 up to Z=92. The leading relativistic deformation correction has been derived analytically and also its influence on one-loop quantum electrodynamic terms has been evaluated. We show the leading corrections to become significant for mid-Z ions and for very heavy elements to even reach the 10^(-6) level.
The finite nuclear size corrections to the relativistic recoil effect in H-like ions are calculated within the Breit approximation. The calculations are performed for the $1s$, $2s$, and $2p_{1/2}$ states in the range $Z =$ 1-110. The obtained results are compared with previous evaluations of this effect. It is found that for heavy ions the previously neglected corrections amount to about 20% of the total nuclear size contribution to the recoil effect calculated within the Breit approximation.
The parity nonconservation effect on the radiative recombination of electrons with heavy hydrogenlike ions is studied. Calculations are performed for the recombination into the $2^1S_0$ state of helium-like thorium and gadolinium, where, due to the near-degeneracy of the opposite-parity $2^1S_0$ and $2^3P_0$ states, the effect is strongly enhanced. Two scenarios for possible experiments are studied. In the first scenario, the electron beam is assumed to be fully polarized while the H-like ions are unpolarized and the polarization of the emitted photons is not detected. In the second scenario, …
The elastic Rayleigh scattering of twisted light and, in particular, the polarization (transfer) of the scattered photons have been analyzed within the framework of second-order perturbation theory and Dirac's relativistic equation. Special attention was paid hereby to the scattering on three different atomic targets: single atoms, a mesoscopic (small) target, and a macroscopic (large) target, which are all centered with regard to the beam axis. Detailed calculations of the polarization Stokes parameters were performed for C^{5+} ions and for twisted Bessel beams. It is shown that the polariza…
Parity nonconservation (PNC) effect in recombination of a polarized electron with a heavy H-like ion in case of resonance with a doubly excited state of the corresponding He-like ion is studied. It is assumed that photons of the energy corresponding to the one-photon decay of the doubly excited state into the $2^1S_0$ or the $2^3P_0$ state are detected at a given angle with respect to the incident electron momentum. Calculations are performed for heliumlike thorium ($Z = 90$) and gadolinium ($Z = 64$), where the $2^1S_0$ and $2^3P_0$ levels are near to cross and, therefore, the PNC effect is s…
The amplitude of two-photon transitions between hyperfine states in hydrogenlike ions is derived based on relativistic Dirac equation and second order perturbation theory. We study angular and linear polarization properties of the photon pair emitted in the decay of $2s$ states, where spin-flip and non-spin-flip transitions are highlighted. We pay particular attention to hydrogenlike uranium, since it is an ideal candidate for investigating relativistic and high-multipole effects, such as spin-flip transitions. Two types of emission patterns are identified: i) non-spin-flip transitions are fou…
We investigate black-body induced energy shifts for low-lying levels of atomic systems, with a special emphasis on transitions used in current and planned high-precision experiments on atomic hydrogen and ionized helium. Fine-structure and Lamb-shift induced black-body shifts are found to increase with the square of the nuclear charge number, whereas black-body shifts due to virtual transitions decrease with increasing nuclear charge as the fourth power of the nuclear charge. We also investigate the decay width acquired by the ground state of atomic hydrogen, due to interaction with black-body…
Nuclear-size correction to the one-loop self-energy in hydrogenlike ions
Innovation Academy for Precision Measurement Science and Technology, Chinese Academy of Sciences（中国科学院精密测量科学与技术创新院）；University of Chinese Academy of Sciences（中国科学院大学）；Department of Physics, St. Petersburg State University（圣彼得堡国立大学物理系）
We have investigated the correction to the hyperfine structure of heavy multicharged ions, which is connected with the nuclear-polarization effect caused by the unpaired bound electron. Numerical calculations are performed for hydrogenlike ions taking into account the dominant collective nuclear excitations. The correction defines the ultimate limit of precision in accurate theoretical predictions of the hyperfine-structure splittings.
A theoretical study of the intense-field multiphoton ionization of hydrogenlike systems is performed by solving the time-dependent Dirac equation within the dipole approximation. It is shown that the velocity-gauge results agree to the ones in length gauge only if the negative-energy states are included in the time propagation. On the other hand, for the considered laser parameters, no significant difference is found in length gauge if the negative-energy states are included or not. Within the adopted dipole approximation the main relativistic effect is the shift of the ionization potential. A…
The determination of the electron mass from Penning-trap measurements with $^{12}$C$^{5+}$ ions and from theoretical results for the bound-electron $g$ factor is described in detail. Some recently calculated contributions slightly shift the extracted mass value. Prospects of a further improvement of the electron mass are discussed both from the experimental and from the theoretical point of view. Measurements with $^4$He$^+$ ions will enable a consistency check of the electron mass value, and in future an improvement of the $^4$He nuclear mass and a determination of the fine-structure constant…
We present the results of numerical calculations of magnetizability ($χ$) of the relativistic one-electron atoms with a pointlike, spinless and motionless nuclei of charge $Ze$. Exploiting the analytical formula for $χ$ recently derived by us [P. Stefa{ń}ska, 2015], valid for an arbitrary discrete energy eigenstate, we have found the values of the magnetizability for the ground state and for the first and the second set of excited states (i.e.: $2s_{1/2}$, $2p_{1/2}$, $2p_{3/2}$, $3s_{1/2}$, $3p_{1/2}$, $3p_{3/2}$, $3d_{3/2}$, and $3d_{5/2}$) of the Dirac one-electron atom. The results for ion…
The hyperfine splitting in hydrogenlike $^{209}$Bi, $^{203}$Tl, and $^{205}$Tl is calculated with the nuclear magnetization determined from experimental data on the hyperfine splitting in the corresponding muonic atoms. The single-particle and configuration-mixing nuclear models are considered. The QED corrections are taken into account for both electronic and muonic atoms. The obtained results are compared with other calculations and with experiment.
NRQED approach to the fine and hyperfine structure corrections of order m$α$ 6 and m$α$ 6 (m/M)-Application to the hydrogen atom The NRQED approach is applied to the calculation of relativistic corrections to the fine and hyperfine structure of hydrogenlike atoms at orders m$α$ 6 and m$α$ 6 (m/M). Results are found to be in agreement with those of the relativistic theory. This confirms that the derived NRQED effective potentials are correct, and may be used for studying more complex atoms or molecules. Furthermore, we verify the equivalence between different forms of the NRQED Lagrangian used …
The ground state hyperfine splitting values and the transition probabilities between the hyperfine structure components of high Z lithiumlike ions are calculated in the range $Z=49-83$. The relativistic, nuclear, QED and interelectronic interaction corrections are taken into account. It is found that the Bohr-Weisskopf effect can be eliminated in a combination of the hyperfine splitting values of the hydrogenlike and lithiumlike ions of an isotope. This gives a possibility for testing the QED effects in a combination of the strong electric and magnetic fields of the heavy nucleus. Using the ex…
A high-precision numerical calculation is reported for the self-energy correction to the hyperfine splitting and to the bound-electron g factor in hydrogenlike ions with low nuclear charge numbers. The binding nuclear Coulomb field is treated to all orders, and the nonperturbative remainder beyond the known $Zα$-expansion coefficients is determined. For the $^3{\rm He}^+$ ion, the nonperturbative remainder yields a contribution of -450 Hz to the normalized difference of the 1S and 2S hyperfine-structure intervals, to be compared with the experimental uncertainty of 71 Hz and with the theoretic…
Relativistic self-consistent-field calculations of the radial hyperfine integrals have been performed in the 4d-shell element ions. The comparison with available experimental results gives an estimate of configuration interaction effects in the hyperfine interaction in these ions. The results can also be used to derive nuclear moments from laserspectroscopic measurements of radioactive isotopes. PACS Numbers: 31.15.Ne, 31.30.Gs, 32.10.Fn
Hyperfine structures of the triplet $n^3S-$states in the four-electron Be-atom(s) and Be-like ions are considered. It is shown that to determine the hyperfine structure splitting in such atomic systems one needs to know the triplet electron density at the central atomic nucleus $ρ_T(0)$. We have developed the procedure which allows allows one to determine such an electron density $ρ_T(0)$ for arbitrary four-electron atoms and ions.
An angle-resolved x-ray spectroscopic scheme is presented for determining the hyperfine splitting of highly charged ions. For helium-like ions, in particular, we propose to measure either the angular distribution or polarization of the $1s2p~^{3}P_{1}, F \rightarrow 1s^{2}~^{1}S_{0}, F_{f}$ emission following the stimulated decay of the initial $1s2s~^{1}S_{0}, F_{i}$ level. It is found that both the angular and polarization characteristics of the emitted x-ray photons strongly depends on the (relative) \textit{splitting} of the partially overlapping hyperfine $1s2p~^{3}P_{1}, F$ resonances an…
In this paper, we used the multiconfiguration Dirac-Fock method to compute with high precision the influence of the hyperfine interaction on the $[Ar]3d^{10} 4s4p ^3P_0$ level lifetime in Zn-like ions for stable and some quasi-stable isotopes of nonzero nuclear spin between Z=30 and Z=92. The influence of this interaction on the $[Ar]3d^{10} 4s4p ^3P_1 - [Ar]3d^{10} 4s4p ^3P_0$ separation energy is also calculated for the same ions.
A complete effective Hamiltonian for relativistic corrections at orders $mα^6$ and $mα^6(m/M)$ in a one-electron molecular system is derived from the NRQED Lagrangian. It includes spin-independent corrections to the energy levels and spin-spin scalar interactions contributing to the hyperfine splitting, both of which had been studied previously. In addition, corrections to electron spin-orbit and spin-spin tensor interactions are newly obtained. This allows improving the hyperfine structure theory in the hydrogen molecular ions. Improved values of the spin-orbit hyperfine coefficient are calcu…
In this paper we present tabulated data for magnetic-dipole-to-electric-quadrupole cross-susceptibilities ($χ_{\textrm{M}1 \to \textrm{E}2}$) for Dirac one-electron atoms with a pointlike, spinless and motionless nucleus of charge $Ze$. Numerical values of this susceptibility for the hydrogen atom ($Z=1$) and for hydrogenic ions with $2 \leqslant Z \leqslant 137$ are computed from the general analytical formula, recently derived by us [P. Stefa{ń}ska, Phys. Rev. A 93 (2016) 022504], valid for an arbitrary discrete energy eigenstate. In this work we provide 30 tables with the values of $χ_{\tex…
The ground-state hyperfine splitting values of high-Z boronlike ions are calculated. Calculation of the interelectronic-interaction contribution is based on a combination of the 1/Z perturbation theory and the large-scale configuration-interaction Dirac-Fock-Sturm method. The screened QED corrections are evaluated utilizing an effective screening potential approach. Total hyperfine splitting energies are presented for several B-like ions of particular interest: {}^{45}Sc{}^{16+}, {}^{57}Fe{}^{21+}, {}^{207}Pb{}^{77+}, and {}^{209}Bi{}^{78+}. For lead and bismuth the experimental values of the …
Energy levels, hyperfine interaction constants, and Landé $g_J$-factors are reported for n=2 states in beryllium-, boron-, carbon-, and nitrogen-like ions from relativistic configuration interaction calculations. Valence, core-valence, and core-core correlation effects are taken into account through single and double-excitations from multireference expansions to increasing sets of active orbitals. A systematic comparison of the calculated hyperfine interaction constants is made with values from the available literature.
The status of experimental measurements and theoretical calculations of the hyperfine induced 2s2p 3P0 -> 2s2 1S0 transition rate in Be-like ions is reviewed. Possible reasons, such as external electromagnetic fields and competing E1M1 two-photon transitions, for presently existing significant discrepancies between experiment and theory are discussed. Finally, directions for future research are outlined.
The rigorous QED evaluation of the one- and two-photon exchange corrections to the ground-state hyperfine splitting in Li-like ions is presented for the wide range of nuclear charge number $Z= 7 - 82$. The calculations are carried out in the framework of the extended Furry picture, i.e., with inclusion of the effective local screening potential in the zeroth-order approximation. The interelectronic-interaction contributions of the third and higher orders are taken into account in the framework of the Breit approximation employing the recursive perturbation theory. In comparison to the previous…
We apply relativistic many-body methods to compute static differential polarizabilities for transitions inside the ground-state hyperfine manifolds of monovalent atoms and ions. Knowing this transition polarizability is required in a number of high-precision experiments, such as microwave atomic clocks and searches for CP-violating permanent electric dipole moments. While the traditional polarizability arises in the second-order of interaction with the externally-applied electric field, the differential polarizability involves additional contribution from the hyperfine interaction of atomic el…
Three models of the nuclear magnetization distribution are applied to predict the hyperfine structure of the hydrogenlike heavy ions and neutral thallium atoms: the uniformly magnetized ball model and single-particle models for the valence nucleon with the uniform distribution and the distribution determined by the Woods-Saxon potential. Results for the hydrogenlike ions are in excellent agreement with previous studies. The application of the Woods-Saxon model is now extended to the neutral systems with the explicit treatment of the electron correlation effects within the relativistic coupled …
The hyperfine induced $2s2p ^3P_0, ^3P_2 \to 2s^2 ^1S_0$ E1 transition probabilities of Be-like ions were calculated using grasp2K based on multi-configuration Dirac-Fock method and HFST packages. It was found that the hyperfine quenching rates are strongly affected by the interference for low-Z Be-like ions, especially for $2s2p ^3P_0 \to 2s^2 ^1S_0$ transition. In particular, the trends of interference effects with atomic number $Z$ in such two transitions are not monotone. The strongest interference effect occurs near Z=7 for $2s2p ^3P_0 \to 2s^2 ^1S_0$ E1 transition, and near Z=9 for $2s2p…
Hyperfine induced $1s2s ^1S_0 \to 1s^2 ^1S_0$ M1 transition probabilities of He-like ions have been calculated from relativistic configuration interaction wavefunctions including the frequency independent Breit interaction and QED effects. Present results for {$^{151}$}Eu and {$^{155}$}Gd are in good agreement with previous calculations [Phys. Rev. A {\bf 63}, 054105 (2001)]. Electronic data are given in terms of a general scaling law in $Z$ that, given isotopic nuclear spin and magnetic moment, allows hyperfine induced decay rates to be estimated for any isotope. The results should be helpful…
We present results on the self-energy correction to the energy levels of hydrogen and hydrogenlike ions. The self energy represents the largest QED correction to the relativistic (Dirac-Coulomb) energy of a bound electron. We focus on the perturbation expansion of the self energy of non-S states, and provide estimates of the so-called A60 perturbative coefficient, which can be considered as a relativistic Bethe logarithm. Precise values of A60 are given for many P, D, F and G states, while estimates are given for other electronic states. These results can be used in high-precision spectroscopy…
The screened QED corrections of the first orders in αand 1/Z to the g factor and the hyperfine splitting of lithiumlike ions are evaluated within ab initio quantum electrodynamical approach. The complete gauge-invariant set of the two-electron self-energy diagrams in the presence of the magnetic field and a dominant part of the two-electron vacuum-polarization diagrams are calculated. The most accurate values of the g factor of Li-like lead and uranium are presented. The theoretical prediction for the specific difference of the hyperfine splittings of H- and Li-like bismuth is improved.
The hyperfine structures of the $2\,^3\!S_1$ and $2\,^3\!P_J$ states of the $^7$Be$^{2+}$ and $^9$Be$^{2+}$ ions are investigated within the framework of the nonrelativistic quantum electrodynamics (NRQED). The uncertainties of present hyperfine splitting results of $^9$Be$^{2+}$ are in the order of several tens of ppm, where two orders of magnitude improvement over the previous theory and experiment values has been achieved. The contribution of nuclear electric quadrupole moment to hyperfine splitting of $^7$Be$^{2+}$ has been studied. A scheme for determining the properties of Be nuclei in t…
We measured the ground-state hyperfine splitting of trapped ${}^{113}$Cd${}^{+}$ ions to be 15199862855.02799(27) Hz with a fractional uncertainty of $1.8\times10^{-14}$. The ions were trapped and laser-cooled in a linear quadrupole Paul trap. The fractional frequency stability was measured to be ${4.2} \times 10^{-13}/\sqrtτ $, obtained from Ramsey fringes of high signal-to-noise ratio and taken over a measurement time of nearly 5 hours, which is close to the short-term stability limit estimated from the Dick effect. Our result is consistent with previous reported values, but the measurement …
The hyperfine splitting of the ground state of H-, Li-, and B-like ions is investigated in details within the range of nuclear numbers Z = 7-28. The rigorous QED approach together with the large-scale configuration-interaction Dirac-Fock-Sturm method are employed for the evaluation of the interelectronic-interaction contributions of first and higher orders in 1/Z. The screened QED corrections are evaluated to all orders in (αZ) utilizing an effective potential approach. The influence of nuclear magnetization distribution is taken into account within the single-particle nuclear model. The speci…
The hyperfine splitting of the ground state of selected B-like ions within the range of nuclear charge numbers $Z=49-83$ is investigated in detail. The rigorous QED approach together with the large-scale configuration-interaction Dirac-Fock-Sturm method are employed for the evaluation of the interelectronic-interaction contributions of first and higher orders in $1/Z$. The screened QED corrections are evaluated to all orders in $αZ$ by using an effective potential. The influence of nuclear magnetization distribution is taken into account within the single-particle nuclear model.
The hyperfine induced $4f^{14}5s5p~^3\mathrm{P}^o_{0,2}~-~4f^{14}5s^2~^1\mathrm{S}_0$ transition probabilities for highly charged Sm-like ions are calculated in the framework of the multi-configuration Dirac-Hartree-Fock method. Electron correlation, the Breit interaction and quantum electrodynamical (QED) effects are taken into account. For ions ranging from $Z=79$ to $Z=94$, $4f^{14}5s5p~^3\mathrm{P}^o_{0}$ is the first excited state, and the hyperfine induced transition is an dominant decay channel. For the $4f^{14}5s5p~^3\mathrm{P}^o_{2}$ state, the hyperfine induced transition (HIT) rates…
Energy levels, magnetic dipole, and electric quadrupole hyperfine structure of the superheavy element rutherfordium (Rf, $Z$=104) and its first three ions are calculated using a combination of the configuration interaction, coupled-cluster single-doubles, and many-body perturbation theory techniques. The results are to be used in future interpretations of the measurements in terms of nuclear magnetic dipole and electric quadrupole momenta. To have a guide on the accuracy of the study, we perform similar calculations for hafnium (Hf, $Z$=72) and its ions. Hf is a lighter analog of Rf with a sim…
Numerous few-electron atomic systems are considered which can be used effectively for observing a potential variation of the fine-structure constant $α$ and the electron-proton mass ratio $m_e/m_p$. We examine optical magnetic dipole transitions between hyperfine-structure components in heavy highly charged H-like and Li-like ions with observably high sensitivity to a variation of $α$ and $m_e/m_p$. The experimental spectra of the proposed systems consist of a strong single line, which simplifies significantly the data analysis and shortens the necessary measurement time. Furthermore, we propo…
The hyperfine structure (hfs) and the g factor of a bound electron are caused by external magnetic fields. For the hfs, the magnetic field is due to the nuclear spin. A uniform-in-space and constant-in-time magnetic field is used to probe the bound-electron g factor. The self-energy corrections to these effects are more difficult to evaluate than those to the Lamb shift. Here, we describe a numerical approach for both effects in the notoriously problematic regime of hydrogen-like bound systems with low nuclear charge numbers. The calculation is nonperturbative in the binding Coulomb field. Acc…
The self-energy corrections to the hyperfine splitting is evaluated for higher excited states in hydrogenlike ions, using an expansion in the binding parameter Zalpha, where Z is the nuclear charge number, and alpha is the fine-structure constant. We present analytic results for D, F and G states, and for a number of highly excited Rydberg states with principal quantum numbers in the range 13 <= n <= 16, and orbital angular momenta l = n-2 and l = n-1. A closed-form, analytic expression is derived for the contribution of high-energy photons, valid for any state with l <= 2$ and arbitrary n, l …
