Relativistic multireference many-body perturbation calculations on multi-valence-electron systems: Benchmarks on Zn-like ions

Marius J. Vilkas and Yasuyuki Ishikawa
Phys. Rev. A 72, 032512 – Published 30 September 2005

Abstract

High-accuracy calculations of term energies and wavelengths of resonance lines in Zn-like ions have been performed as benchmarks in the quest for accurate theoretical treatments of relativity, electron correlation, and quantum electrodynamic effects in multivalence-electron systems. Computed wavelengths of the 4s2S014s4pP1o1 transitions are compared with the recent high-resolution wavelength measurements using electron-beam ion traps [E. Träbert, P. Beiersdorfer, and H. Chen, Phys. Rev. A 70, 032506 (2004)], a sensitive means of testing electronic structure theory that has revealed the inadequacies in treating multiple valence electrons in the extant relativistic many-body calculations.

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  • Received 31 May 2005

DOI:https://doi.org/10.1103/PhysRevA.72.032512

©2005 American Physical Society

Authors & Affiliations

Marius J. Vilkas and Yasuyuki Ishikawa*

  • Department of Chemistry, University of Puerto Rico, P.O. Box 23346, San Juan, Puerto Rico 00931-3346, USA

  • *Electronic address: ishikawa@rrpac.upr.clu.edu

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Vol. 72, Iss. 3 — September 2005

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