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Spin–orbit coupling within a two-component density functional theory approach: theory, implementation and first applications

Actinides Electronic Structure - Modeling Properties

Publication Details

  • Authors: L. Gagliardi, B. Schimmelpfennig, L. Maron, U. Wahlgren, and A. Willetts
  • Publication Number: 25
  • Year: 2001
  • Journal: Chem. Phys. Lett.

Full Citation

L. Gagliardi, B. Schimmelpfennig, L. Maron, U. Wahlgren, and A. Willetts, Spin–orbit coupling within a two-component density functional theory approach: theory, implementation and first applications, Chem. Phys. Lett., 2001, 344, 207–212. DOI: 10.1016/S0009-2614(01)00761-8