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RESEARCH PRODUCT

New Nuclear Magnetic Moment of Bi209 : Resolving the Bismuth Hyperfine Puzzle

Stefan E. SchmidtStefan E. SchmidtMichael VogelWilfried NörtershäuserJ. UllmannJ. UllmannBenjamin ScheibeV. M. ShabaevAndrey V. VolotkaAndrey V. VolotkaAlexei F. PrivalovChristopher GeppertFlorian KrausLeonid V. SkripnikovLeonid V. SkripnikovB. Kresse

subject

Physics010304 chemical physicsMagnetic momentGeneral Physics and Astronomychemistry.chemical_element01 natural sciencesIonBismuthCoupled clusterchemistry0103 physical sciencesNuclear magnetic momentDensity functional theoryAtomic physics010306 general physicsGround stateHyperfine structure

description

A recent measurement of the hyperfine splitting in the ground state of Li-like ${^{208}\mathrm{Bi}}^{80+}$ has established a ``hyperfine puzzle''---the experimental result exhibits a $7\ensuremath{\sigma}$ deviation from the theoretical prediction [J. Ullmann et al., Nat. Commun. 8, 15484 (2017); J. P. Karr, Nat. Phys. 13, 533 (2017)]. We provide evidence that the discrepancy is caused by an inaccurate value of the tabulated nuclear magnetic moment (${\ensuremath{\mu}}_{I}$) of $^{209}\mathrm{Bi}$. We perform relativistic density functional theory and relativistic coupled cluster calculations of the shielding constant that should be used to extract the value of ${\ensuremath{\mu}}_{I}(^{209}\mathrm{Bi})$ and combine it with nuclear magnetic resonance measurements of $\mathrm{Bi}({\mathrm{NO}}_{3}{)}_{3}$ in nitric acid solutions and of the hexafluoridobismuthate(V) ${\mathrm{BiF}}_{6}^{\ensuremath{-}}$ ion in acetonitrile. The result clearly reveals that ${\ensuremath{\mu}}_{I}(^{209}\mathrm{Bi})$ is much smaller than the tabulated value used previously. Applying the new magnetic moment shifts the theoretical prediction into agreement with experiment and resolves the hyperfine puzzle.

https://doi.org/10.1103/physrevlett.120.093001