alkali-metal ion / energy barriers / cobalamin systems / chemical shifts / excitation energy / metal / quantum-chemical calculations / metal-to-ligand charge transfer excitations / calculated potential energy curves / e-conformer / water clusters containing alkali metal ions / lowest energy band / alkali metal ion / lower energy / chemical calculations / activation energy / /
Organization
CTCC / /
Person
M.Repisky / Z.Rinkevicius / K. Ruud / D. J. Tozer / T.B.Demissie / T.Helgaker / K.Ruud By / O. B. Lutnæs / Cob(I)alamin / A.O.Simakov / V / S.Komorovsky / J. Gauss / H.Ågren E.Malkin / A. M. Teale / /