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State-specific electronic structure theory provides a route towards balanced excited-state wave functions by exploiting higher-energy stationary points of the electronic energy. Multiconfigurational wave function approximations can describe…

Chemical Physics · Physics 2023-07-19 Antoine Marie , Hugh G. A. Burton

Recent experimental advances have made it possible to study excited structure in superheavy nuclei. The observed states have often been interpreted as quasi-particle excitations. We show that in superheavy nuclei collective vibrations…

Nuclear Theory · Physics 2008-11-26 Yang Sun , Gui-Lu Long , Falih Al-Khudair , Javid A. Sheikh

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…

Atomic Physics · Physics 2017-08-02 Alexei M Frolov

We study the rovibronic transitions in NaK$_2$ between its electronic ground state $1^2A'$ and its second excited state $3^2A'$, to identify possible pathways for the creation of ultracold ground-state triatomic molecules. Our methodology…

Quantum Gases · Physics 2026-01-16 Baraa Shammout , Leon Karpa , Silke Ospelkaus , Eberhard Tiemann , Olivier Dulieu

A determination of the excited energy eigenstates of the nucleon, $s=c{1}{2}$, $I={1}{2}$, $N^{\pm}$, is presented in full QCD using 2+1 flavor PACS-CS gauge configurations. The correlation-matrix method is used and is built using standard…

High Energy Physics - Lattice · Physics 2013-06-26 M. Selim Mahbub , Waseem Kamleh , Derek B. Leinweber , Peter J. Moran , Anthony G. Williams

Hyperfine structure of the ground $2^{2}S-$states of the three-electron atoms and ions is investigated. By using our recent numerical values for the doublet electron density at the atomic nucleus we determine the hyperfine structure of the…

Atomic and Molecular Clusters · Physics 2016-07-20 Alexei M. Frolov

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…

Atomic Physics · Physics 2009-11-13 N. S. Oreshkina , D. A. Glazov , A. V. Volotka , V. M. Shabaev , I. I. Tupitsyn , G. Plunien

We investigate single-particle energy spectra of the hydroxyl free radical (OH) in the lowest electronic and rovibrational level under combined static electric and magnetic fields, as an example of heteronuclear polar diatomic molecules. In…

Quantum Gases · Physics 2015-06-23 Kenji Maeda , Michael L Wall , Lincoln D Carr

Molecular ions formed in cold hybrid ion-atom experiments may find interesting applications ranging from precision measurements to controlled chemical reactions. Here, we investigate electronic structure of the Sr$_2^+$ molecular ion, which…

Atomic Physics · Physics 2020-06-17 Michał Śmiałkowski , Tatiana Korona , Michał Tomza

A recently developed version of the configuration interaction (CI) method for open shells with a large number of valence electrons has been used to study two heavy atoms, californium (Cf, Z= 98) and einsteinium (Es, Z= 99). Motivated by…

Atomic Physics · Physics 2023-03-31 Saleh O. Allehabi , V. A. Dzuba , V. V. Flambaum

Precision calculations of the fine and hyperfine structure of muonic atoms are performed in a relativistic approach and results for muonic 205 Bi, 147 Sm, and 89 Zr are presented. The hyperfine structure due to magnetic dipole and electric…

Atomic Physics · Physics 2017-10-04 Niklas Michel , Natalia S. Oreshkina , Christoph H. Keitel

We consider two-color heteronuclear photoassociation of atoms into dipolar molecules in the J=1 electro-vibrational ground state, where a free-ground laser couples atoms directly to the ground state and a free-bound laser couples the atoms…

Quantum Gases · Physics 2009-11-19 Matt Mackie , Catherine DeBrosse

Studies on the interactions between an alkali atom and an alkaline earth ion at low energy are important in the field of cold chemistry. In this paper we, extensively, study the structure, interactions, and dynamics of (MgCs)$^+$ molecular…

Atomic Physics · Physics 2022-10-05 Mohamed Farjallah , Dibyendu Sardar , Bimalendu Deb , Hamid Berriche

We demonstrate coherent microwave control of rotational and hyperfine states of trapped, ultracold, and chemically stable $^{23}$Na$^{40}$K molecules. Starting with all molecules in the absolute rovibrational and hyperfine ground state, we…

Quantum Gases · Physics 2016-06-08 Sebastian A. Will , Jee Woo Park , Zoe Z. Yan , Huanqian Loh , Martin W. Zwierlein

The computational description of correlated electronic structure, and particularly of excited states of many-electron systems, is an anticipated application for quantum devices. An important ramification is to determine the dominant…

We make precise calculation of hyperfine structure of $S$-states in muonic ions of lithium, beryllium and boron in quantum electrodynamics. Corrections of orders $\alpha^5$ and $\alpha^6$ due to the vacuum polarization, nuclear structure…

High Energy Physics - Phenomenology · Physics 2018-10-10 A. E. Dorokhov , A. A. Krutov , A. P. Martynenko , F. A. Martynenko , O. S. Sukhorukova

Iron-sulfur clusters conduct a wide variety of biochemical reactions that are conserved across all domains of life. The hyperfine structure of reactive ligands of these clusters can be studied experimentally and theoretically by means of…

Chemical Physics · Physics 2025-08-22 William C. Robinson , Victoria Pascutti , David A. Hall , Martín A. Mosquera

Large-amplitude molecular motions which occur during isomerization can cause significant changes in electronic structure. These variations in electronic properties can be used to identify vibrationally-excited eigenstates which are…

Chemical Physics · Physics 2019-03-27 Bryan M. Wong

We investigate within a quark-meson coupling (QMC) model, the structure of the bound $\Xi^-$ hypernucleus $^{15}{\!\!\!_{\Xi^-}}$C ($^{14}$N + $\Xi^-$), which has been observed in a recent analysis of the KEK-E373 experiment. In the QMC…

Nuclear Theory · Physics 2019-01-21 R. Shyam , K. Tsushima

We calculate hyperfine structure intervals $\Delta E^{hfs}(2P_{1/2})$ and $\Delta E^{hfs}(2P_{3/2})$ for P-states in muonic ions of lithium, beryllium and boron. To construct the particle interaction operator in momentum space we use the…

High Energy Physics - Phenomenology · Physics 2020-01-01 A. E. Dorokhov , A. P. Martynenko , F. A. Martynenko , O. S. Sukhorukova