Combination of the single-double–coupled-cluster and the configuration-interaction methods: Application to barium, lutetium, and their ions

V. A. Dzuba
Phys. Rev. A 90, 012517 – Published 18 July 2014

Abstract

A version of the method of accurate calculations for few-valence-electron atoms which combines linearized single-double–coupled-cluster method with the configuration-interaction technique is presented. The use of the method is illustrated by calculations of the energy levels for Ba, Ba+, Lu, Lu+, and Lu2+. Good agreement with experiment is demonstrated and comparison with previous version of the method [M. S. Safronova et al., Phys. Rev. A 80, 012516 (2009)] is made.

  • Received 2 June 2014

DOI:https://doi.org/10.1103/PhysRevA.90.012517

©2014 American Physical Society

Authors & Affiliations

V. A. Dzuba

  • School of Physics, University of New South Wales, Sydney 2052, Australia

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Vol. 90, Iss. 1 — July 2014

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