Calculation of Atomic Electron Affinities and Ionization Potentials

D. Sundholm, J. Olsen, "Large MCHF Calculations on the Electron Affinity of Boron", Chem. Phys. Letters 171 (1990) 53-57.

D. Sundholm, J. Olsen, "Finite Element MCHF Calculations on Excitation Energies and the Ionization Potential of Carbon", Chem. Phys. Letters 182 (1991) 497-502.

D. Sundholm, J. Olsen, S.A. Alexander, "Finite-Element MCHF Calculations on the Excitation Energies and the Ionization Potential of Oxygen", J. Chem. Phys. 96 (1992) 5229-5232.

D. Sundholm, J. Olsen, "The Exactness of the Extended Koopmans' Theorem: A Numerical Study", J. Chem. Phys. 98 (1993) 3999-4002.

D. Sundholm, J. Olsen, "Response to "Comment on 'The Exactness of the Extended Koopmans' Theorem: A Numerical Study'"", J. Chem. Phys. 99 (1993) 6222-6223.

D. Sundholm, J. Olsen, "Core-Valence Correlation Effects on the Ground State Electron Affinity of Calcium", Chem. Phys. Letters 217 (1994) 451-455.

J. Olsen, L.G.M. Pettersson, D. Sundholm, "Calculations of Excitation Energies and Electron Affinities for Be", J. Phys. B (At. Mol. Opt. Phys.) 27 (1994) 5575-86.

D. Sundholm, J. Olsen, "Finite-Element Multiconfiguration Hartree-Fock Calculations of Electron Affinities of Manganese", Chem. Phys. Letters 233 (1995) 115-122.

D. Sundholm, "Core-Valence Correlation Effects on the Ground State Electron Affinity of Strontium and Barium", J. Phys. B (At. Mol. Opt. Phys.) 28 (1995) L399-L404.

J. Olsen, D. Sundholm, "On Perturbation Expansions of the Extended Koopmans' Theorem", Chem. Phys. Letters 288 (1998) 282-288.

D. Sundholm, M. Tokman, P. Pyykkö, E. Eliav, U. Kaldor, "Ab Initio Calculations of the Ground State Electron Affinities of Gallium and Indium", J. Phys. B: At. Mol. Opt. Phys 32 (1999) 5853-5859.



Dage Sundholm