Theoretical studies of molecular ions: BeH−

Über die Zuordnung von Wellenfunktionen und Eigenwerten zu den Einzelnen Elektronen Eines Atoms

1934 • 6,923 citations

Electronic Structure of Diatomic Molecules. VI.A. Hartree—Fock Wavefunctions and Energy Quantities for the Ground States of the First-Row Hydrides, AH

1967 • 645 citations

Direct calculation of ionization energies

1973 • 540 citations

Direct calculation of ionization potentials of closed-shell atoms and molecules

1973 • 321 citations

Theory of electron affinities of small molecules

1973 • 285 citations

Improved calculations of ionization potentials of closed-shell molecules

1973 • 177 citations

On the breakdown of the Koopmans' theorem for nitrogen

1973 • 166 citations

Many-Body Green's Functions for Finite, Nonuniform Systems: Applications to Closed Shell Atoms

1972 • 151 citations

Calculation of the vertical ionization potentials of formaldehyde by means of perturbation theory

1971 • 115 citations

Perturbation corrections to Koopmans' theorem. II. A study of basis set variation

1974 • 82 citations

Perturbation corrections to Koopmans' theorem. III. Extension to molecules containing Si, P, S, and Cl and comparison with other methods

1974 • 73 citations

The self-consistent determination of the ion and neutral molecule wavefunctions in a theory of electron affinities and ionization potentials

1974 • 50 citations

The vertical ionization potentials of hypofluorous acid as calculated by perturbation corrections to koopmans' theorem

1974 • 34 citations