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Spin-free Dirac-Coulomb calculations augmented with a perturbative treatment of spin-orbit effects at the

Lan Cheng1, Stella Stopkowicz, Jürgen Gauss

  • 1Institute for Theoretical Chemistry, Department of Chemistry and Biochemistry, The University of Texas at Austin, Austin, Texas 78712, USA.

The Journal of Chemical Physics
|December 11, 2013
PubMed

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