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Soviet Physics Journal

, Volume 34, Issue 10, pp 871–876 | Cite as

Relativistic multiconfiguration time-dependent self-consistent-field theory for molecules

  • A. V. Glushkov
Optics and Spectroscopy

Abstract

A relativistic multiconfiguration time-dependent self-consistent-field theory is constructed for molecules. Equations are derived for relativistic response functions, and their solutions are found in general form for multielectron molecules. Within the adopted approach, the equivalence of the results of relativistic calculations of the oscillator strengths in the molecules is demonstrated by using equations in “length” and “velocity.” A relativistic formalism is formulated for the Liouville-Dirac-Fock self-consistent field; this formalism may be very effective in molecular calculations.

Keywords

Response Function Oscillator Strength Relativistic Response Relativistic Formalism Relativistic Calculation 
These keywords were added by machine and not by the authors. This process is experimental and the keywords may be updated as the learning algorithm improves.

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Copyright information

© Plenum Publishing Corporation 1992

Authors and Affiliations

  • A. V. Glushkov
    • 1
  1. 1.Odessa M. V. Lomonosov Technological InstituteUSSR

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