Relativistic effects on R e and D e in AgH and AuH from all-electron Dirac–Hartree–Fock calculations

Relativistic Self-Consistent-Field Theory for Closed-Shell Atoms

1967 • 343 citations

A b i n i t i o effective core potentials including relativistic effects. I. Formalism and applications to the Xe and Au atoms

1977 • 239 citations

Dirac-Fock one-centre calculations. The molecules CuH, AgH and AuH including p-type symmetry functions

1976 • 176 citations

A b i n i t i o studies of AuH, AuCl, HgH and HgCl2 using relativistic effective core potentials

1978 • 146 citations

Relativistic self-consistent-field methods for molecules. I. Dirac–Fock multiconfiguration self-consistent-field theory for molecules and a single-determinant Dirac–Fock self-consistent-field method for closed-shell linear molecules

1980 • 78 citations

Variational solution of the dirac equation within a multicentre basis set of gaussian functions

1980 • 63 citations