Relativistic Wood-Boring ab initio model potential calculations on the platinum atom

Gaussian basis sets for molecular calculations. The representation of 3<i>d</i> orbitals in transition-metal atoms

P. Jeffrey Hay · The Journal of Chemical Physics · 1977 · 2K citations

Natural Sciences, Chemistry, Physics +14

Approximate relativistic corrections to atomic radial wave functions*

Robert D. Cowan, D. C. Griffin · Journal of the Optical Society of America · 1976 · 988 citations

Natural Sciences, Chemistry, Physics +17

Improved Pauli Hamiltonian for local-potential problems

J. H. Wood, A. M. Boring · Physical review. B, Condensed matter · 1978 · 315 citations

Natural Sciences, Physics, Atomic Physics +14

Theoretical studies of oxidative addition and reductive elimination. 3. Carbon-hydrogen and carbon-carbon reductive coupling from palladium and platinum bis(phosphine) complexes

John J. Low, William A. Goddard · Journal of the American Chemical Society · 1986 · 284 citations

Natural Sciences, Chemistry, Catalysis +12

Electronic-structure methods for heavy-atom molecules

Russell M. Pitzer, N. W. Winter · The Journal of Physical Chemistry · 1988 · 273 citations

Natural Sciences, Chemistry, Physics +8