• Theoretical studies of natural and magnetic circular dichroism 

      Solheim, Harald (Doctoral thesis; Doktorgradsavhandling, 2011-06-23)
      This dissertation presents theoretical studies mainly of natural and magnetic circular dichroism spectra. For magnetic circular dichroism, the importance of electron correlation effects, here included at the density-functional functional level of theory, and solvent effects are discussed, both being shown to have significant impact on the final spectra. In addition, a unified approach for calculating ...