Comparative studies of the magnetic dipole and electric quadrupole hyperfine constants for the ground and low lying excited states of ^{25}Mg^{+}

We have employed the relativistic coupled cluster theory to calculate the magnetic dipole and electric quadrupole hyperfine constants for the ground and low lying excited states of singly ionized magnesium. Comparison with experimental and the other theoretical results are done and predictions are also made for a few low lying excited states which could be of interest. We have made comparative studies of the important many body effects contributing to the hyperfine constants for the different states of the ion.Comment: 3 figures, Late

Relativistic and correlation effects in atoms

This review article deals with some case studies of relativistic and correlation effects in atomic systems. After a brief introduction to relativistic many-electron theory, a number of applications ranging from correlation energy to parity non-conservation in atoms are considered. There is a special emphasis on relativistic coupled-cluster theory as most of the results presented here are based on it.Comment: Review article, 4 eps figures, latex 2

Relativistic Coupled-Cluster Theory of Atomic Parity Nonconservation: Application to 137^{137}Ba+^+

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 single, double and partial triple excitations, we have achieved an accuracy of less than one percent. If the accuracy of our calculation can be matched by the proposed parity nonconservation experiment in Ba$^+$ for the above transition,then the combination of the two results would provide an independent non accelerator test of the Standard Model of particle physics.Comment: 4 pages, 1 figure, Submitted to PR

Study of HgOH to Assess Its Suitability for Electron Electric Dipole Moment Searches

In search of suitable molecular candidates for probing the electric dipole moment (EDM) of the electron (de), a property that arises due to parity and time-reversal violating (P,T-odd) interactions, we consider the triatomic mercury hydroxide (HgOH) molecule. The impetus for this proposal is based on previous works on two systems: the recently proposed ytterbium hydroxide (YbOH) experiment [Phys. Rev. Lett. 119, 133002 (2017)] that demonstrates the advantages of polyatomics for such EDM searches, and the finding that mercury halides provide the highest enhancement due to de compared to other diatomic molecules [Phys. Rev. Lett. 114, 183001 (2015)]. We identify the ground state of HgOH as being in a bent geometry, and show that its intrinsic EDM sensitivity is comparable to the corresponding value for YbOH. Along with the theoretical results, we discuss plausible experimental schemes for an EDM measurement in HgOH. Furthermore, we provide pilot calculations of the EDM sensitivity for de for HgCH₃ and HgCF₃, that are natural extensions of HgOH

Relativistic coupled cluster calculations of the energies for rubidium and cesium atoms

Ionization potentials and excitation energies of rubidium and cesium atoms are computed using the relativistic coupled cluster (CC) method. The effect of electron correlations on the ground and excited state properties is investigated using different levels of CC approximations and truncation schemes. The present work demonstrates that the even-parity channel truncation scheme produces results almost as accurate as obtained from the all-parity channel approximation scheme at a reduced computational cost. The present study also indicates that for a given basis the linearized CC method tends to overestimate the ground and excited state properties compared to the full CC method

Ab initio determination of the lifetime of the 62P3/26^2P_{3/2} state f or 207Pb+^{207}Pb^+ by relativistic many-body theory

Relativistic coupled-cluster(RCC) theory has been employed to calculate the life time of the $6 ^2P_{3/2}$ state of single ionized lead($^{207}Pb$) to an accurac y of 3% and compared with the corresponding value obtained using second order r elativistic many-body perturbation theory(RMBPT). This is one of the very few ap plications of this theory to excited state properties of heavy atomic systems. C ontributions from the different electron correlation effects are given explicitl y