Multiple Solutions to the Hartree-Fock Problem. I. General Treatment of Two-Electron Closed-Shell Systems

The Quantum Mechanics of Many-Body Systems

1961 • 935 citations

Stability conditions and nuclear rotations in the Hartree-Fock theory

1960 • 818 citations

Study of the Electronic Structure of Molecules. II. Wavefunctions for the NH3+HCl→NH4Cl Reaction

1967 • 234 citations

Stability of Hartree-Fock States

1962 • 133 citations

Hartree—Fock—Roothaan Wavefunctions, Potential Curves, and Charge-Density Contours for the HeH+(X 1Σ+) and NeH+(X 1Σ+) Molecule Ions

1965 • 129 citations

Molecular Binding Energies

1966 • 127 citations

The Approximate Solution of Schrödinger Equations by a Least Squares Method

1942 • 98 citations

Geometry of Molecules. III. F2O, Li2O, FOH, LiOH

1966 • 94 citations

Gaussian Basis SCF Calculations for OH−, H2O, NH3, and CH4

1967 • 82 citations

Heats of Reaction from Hartree—Fock Energies of Closed-Shell Molecules

1967 • 46 citations

The Absence of a Barrier in the Theoretical Potential Energy Surface for the Reaction of Hydride with Hydrogen Fluoride

1966 • 18 citations

Mathematical Properties of Frost's Local-Energy Method

1966 • 18 citations

Explanation of Some Differences in the Correlation Energies of CH4, Ne, and NH4+

1965 • 12 citations