Semi-empirical effective pair correlation parameters and correlation energies of BH, CH, NH, OH, HF, N2, and CH4

Electronic Population Analysis on LCAO–MO Molecular Wave Functions. I

1955 • 10,259 citations

Modern quantum chemistry

1966 • 2,558 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

Electronic Structure of Diatomic Molecules. III. A. Hartree—Fock Wavefunctions and Energy Quantities for N2(X1Σg+) and N2+(X2Σg+, A2Πu, B2Σu+) Molecular Ions

1966 • 459 citations

Studies in Molecular Structure. II. LCAO-MO-SCF Wave Functions for Selected First-Row Diatomic Molecules

1960 • 399 citations

Correlation Energy for Atomic Systems

1963 • 341 citations

Electronic Structure of N2, CO, and BF

1964 • 286 citations

Many-Electron Theory of Nonclosed-Shell Atoms and Molecules. I. Orbital Wavefunction and Perturbation Theory

1966 • 203 citations

The energy and screening constants of the hydrogen molecule

1937 • 187 citations

Molecular Binding Energies

1966 • 127 citations

Optimized Molecular Orbital Wavefunctions for Methane Constructed from a Minimum Basis Set

1967 • 119 citations

Hellmann-Feynman Theorem and Correlation Energies

1962 • 110 citations

Many-Electron Theory of Atoms and Molecules. V. First-Row Atoms and Their Ions

1964 • 103 citations

The electronic structure of the oxygen molecule

1951 • 102 citations

Many-Electron Theory of Atoms and Molecules. IV. Be Atom and Its Ions

1964 • 99 citations

Correlation Energy and Molecular Properties of Hydrogen Fluoride

1967 • 85 citations

Inter- and Intra-Atomic Correlation Energies and Theory of Core-Polarization

1960 • 83 citations

Hartree—Fock Approximation of CH4 and NH4+

1963 • 83 citations

Theory of Atomic Structure Including Electron Correlation

1968 • 82 citations

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

1967 • 82 citations

Electronic Structure of Some Diatomic Hydrides

1958 • 60 citations

Correlation Energy in the CH4 Molecule

1963 • 41 citations

Dissociation Energy Computations in Diatomic Molecules: An Example

1963 • 39 citations

Self-Consistent Field Calculation of the Ground State of Methane

1964 • 27 citations

Studies in Molecular Structure. III. Populations Analyses for Selected First-Row Diatomic Molecules

1961 • 25 citations

Approximate molecular orbital theory for inorganic molecules

1970 • 14 citations

Correlation effects in the excited states of atoms the 1s22sn2pm configuration of carbon, nitrogen, and oxygen

2009 • 9 citations