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Optics and Spectroscopy, 2018 Volume 124, Issue 4, Pages 435–440 (Mi os1018)

This article is cited in 20 papers

Spectroscopy of atoms and molecules

Electronic transition dipole moments in relativistic coupled-cluster theory: the finite-field method

A. V. Zaitsevskiiab, L. V. Skripnikovac, A. V. Kudrinb, A. V. Oleinichenkoab, E. Eliavd, A. V. Stolyarovb

a The Petersburg Nuclear Physics Institute, The National Research Center "Kurchatov Institute", Gatchina, Leningrad oblast, 188300, Russia
b Lomonosov Moscow State University, Moscow, 119991, Russia
c St. Petersburg State University, St. Petersburg, 199034, Russia
d Tel Aviv University, 69978 Tel Aviv, Israel

Abstract: The determination of the matrix elements of single-electron operators for the transitions between electronic states (primarily, the dipole moments of electron transitions) is one of the critical problems in simulating the atomic and molecular spectra. In this study, the efficiency of a simple version of the finite-field method for calculating these values within the Fock-space coupled-cluster theory has been investigated.

Received: 28.11.2017

DOI: 10.21883/OS.2018.04.45739.268-17


 English version:
Optics and Spectroscopy, 2018, 124:4, 451–456

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