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Relativistic Continuum Random Phase Approximation (CRPA) is used to investigate collective excitation phenomena in several spherical nuclei along the periodic table. We start from relativistic mean field calculations based on a covariant…

Nuclear Theory · Physics 2011-03-21 J. Daoutidis , P. Ring

We report a systematic study of the hyperfine interaction between the electron spin of a single nitrogen-vacancy (NV) defect in diamond and nearby $^{13}$C nuclear spins, by using pulsed electron spin resonance spectroscopy. We isolate a…

Mesoscale and Nanoscale Physics · Physics 2015-06-04 A. Dréau , J. -R. Maze , M. Lesik , J. -F. Roch , V. Jacques

We reveal limitations of several standard coupled-cluster (CC) methods with perturbation-theorybased noniterative or approximate iterative treatments of triple excitations when applied to thedetermination of highly accurate potential energy…

Chemical Physics · Physics 2021-10-04 Jan Schnabel , Lan Cheng , Andreas Köhn

We consider the rank-reduced coupled-cluster theory with single and double excitations (RR-CCSD) introduced recently [Parrish \emph{et al.}, J. Chem. Phys. {\bf 150}, 164118 (2019)]. The main feature of this method is the decomposed form of…

Chemical Physics · Physics 2022-02-21 Michał Lesiuk

Physics of high-$T_c$ superconducting cuprates is obscured by the effect of strong electronic correlations. One way to overcome the problem is to seek for an exact solution at least within the small cluster and expand it to the whole…

Strongly Correlated Electrons · Physics 2023-07-19 V. I. Kuz'min , S. V. Nikolaev , M. M. Korshunov , S. G. Ovchinnikov

We have calculated parity nonconserving 7s - 6d_{3/2} amplitude E_PNC in 223Ra+ using high-precision relativistic all-order method where all single and double excitations of the Dirac-Fock wave functions are included to all orders of…

Atomic Physics · Physics 2015-05-13 Rupsi Pal , Dansha Jiang , M. S. Safronova , U. I. Safronova

Pairing correlation of Cooper pair is a fundamental property of multi-fermion interacting systems. For nucleons, two modes of the Cooper-pair coupling may exist, namely of $S_{12}=0$ with $L_{12}=0$ (spin-singlet s-wave) and $S_{12}=1$ with…

Nuclear Theory · Physics 2021-05-18 Tomohiro Oishi , Goran Kruzic , Nils Paar

We report the result of our {\it ab initio} calculation of the $6s ^2S_{1/2} \to 5d ^2D_{3/2}$ parity nonconserving electric dipole transition amplitude in $^{137}\text{Ba}^+$ based on relativistic coupled-cluster theory. Considering…

Atomic Physics · Physics 2009-11-11 Bijaya K. Sahoo , Rajat Chaudhuri , B. P. Das , Debashis Mukherjee

We carry out first-principle calculations of scalar and tensor components of the static electric dipole polarizabilities of six low-lying states of lithium (Li), sodium (Na) and potassium (K) alkali atoms in the linear response approach.…

Atomic Physics · Physics 2025-04-22 A. Chakraborty , B. K. Sahoo

The relativistic coupled-cluster (RCC) method is a powerful many-body method, particularly in the evaluation of electronic wave functions of heavy atoms and molecules, and can be used to calculate various atomic and molecular properties.…

Atomic Physics · Physics 2019-12-09 Nanako Shitara , B. K. Sahoo , T. Watanabe , B. P. Das

A relativistic coupled-cluster (RCC) theory is implemented to study electron impact excitations of atomic species. As a test case, the electron impact excitations of the $3s ~ ^2S_{1/2} - 3p ~ ^2P_{1/2;3/2}$ resonance transitions are…

Atomic Physics · Physics 2018-02-14 L. Sharma , B. K. Sahoo , P. Malkar , R. Srivastava

The hyperpolarization of nuclear spins can enable powerful imaging and sensing techniques provided the hyperpolarization is sufficiently long-lived. Recent experiments on nanodiamond $^{13}$C nuclear spins demonstrate that relaxation times…

Mesoscale and Nanoscale Physics · Physics 2024-02-20 Gargee Sharma , Torsten Gaebel , Ewa Rej , David J. Reilly , Sophia E. Economou , Edwin Barnes

Large-scale calculations of the E1 strength are performed within the random phase approximation (RPA) based on the relativistic point-coupling mean field approach in order to derive the radiative neutron capture cross sections for all…

Nuclear Theory · Physics 2015-06-11 I. Daoutidis , S. Goriely

In the calculation of the $K^+$-nucleus cross sections, the coupling of the mesons exchanged between the $K^+$ and the target nucleons to the polarization of the Fermi and Dirac seas has been taken into account. This polarization has been…

Nuclear Theory · Physics 2009-10-28 J. C. Caillon , J. Labarsouque

We calculate nuclear spin-dependent parity non-conserving $E1$-amplitudes for optical transition $6p_{1/2,F} -> 6p_{3/2,F'}$ and for hyperfine transition $6p_{1/2,F} -> 6p_{1/2,F'}$ in Tl. Experimental limit on the former amplitude placed…

Atomic Physics · Physics 2016-09-08 Mikhail Kozlov

A phenomenological alpha-cluster model based on np-pair interactions and the charge symmetry of nuclear force allows one to estimate the Coulomb energy, the Coulomb radius R_C, the Coulomb energy of the last proton interaction with the…

Nuclear Theory · Physics 2018-06-26 G. K. Nie

Determination of nuclear moments for many nuclei relies on the computation of hyperfine constants, with theoretical uncertainties directly affecting the resulting uncertainties of the nuclear moments. In this work we improve the precision…

Atomic Physics · Physics 2022-01-05 S. G. Porsev , M. S. Safronova , M. G. Kozlov

The direct ring coupled-cluster doubles (drCCD)-based random phase approximation (RPA) has provided an attractive framework for the development and application of RPA-related methods. However, a potential unphysical solution issue recently…

Chemical Physics · Physics 2025-08-18 Ruiheng Song , Xiliang Gong , Hong-Zhou Ye

The relativistic coupled-clusters method combined with the generalized relativistic effective core potential approach and nonvariational one-center restoration technique is applied to evaluation of parameters of spin-rotational effective…

Atomic Physics · Physics 2014-12-22 L. V. Skripnikov , A. D. Kudashov , A. N. Petrov , A. V. Titov

Efficient hyperpolarisation of nuclear spins via optically active defect centers, such as the nitrogen vacancy (NV) center in diamond, has great potential for enhancing NMR based quantum information processing and nanoscale magnetic…