Spin-Generalized SCF Wavefunctions for H2O, OH, and O

The Nature of the Chemical Bond

1939 • 13,296 citations

Spectra of diatomic molecules

1950 • 5,975 citations

Gaussian-Type Functions for Polyatomic Systems. I

1965 • 4,930 citations

Self-Consistent Field Theory for Open Shells of Electronic Systems

1960 • 1,927 citations

N�herungsmethode zur L�sung des quantenmechanischen Mehrk�rperproblems

1930 • 1,701 citations

Localized Atomic and Molecular Orbitals

1963 • 1,526 citations

Electronic spectra and electronic structure of polyatomic molecules

1966 • 1,481 citations

Rotation-Vibration Spectra of Deuterated Water Vapor

1956 • 1,300 citations

Quantum Theory of Many-Particle Systems. III. Extension of the Hartree-Fock Scheme to Include Degenerate Systems and Correlation Effects

1955 • 1,103 citations

Basic principles of organic chemistry

1965 • 988 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

Localized Atomic and Molecular Orbitals. II

1965 • 305 citations

One-Electron Properties of Near-Hartree–Fock Wavefunctions. I. Water

1968 • 291 citations

Improved Quantum Theory of Many-Electron Systems. II. The Basic Method

1967 • 265 citations

Improved Quantum Theory of Many-Electron Systems. I. Construction of Eigenfunctions of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mover><mml:mrow><mml:mi>S</mml:mi></mml:mrow><mml:mrow><mml:mi>^</mml:mi></mml:mrow></mml:mover><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msup></mml:mrow></mml:math>Which Satisfy Pauli's Principle

1967 • 237 citations

The molecular orbital theory of chemical valency. IV. The significance of equivalent orbitals

1950 • 192 citations

A Modification of the Lewis-Langmuir Octet Rule

1961 • 174 citations

Approximate Hartree–Fock Wavefunctions, One-Electron Properties, and Electronic Structure of the Water Molecule

1968 • 173 citations

Electronic Structure of Molecules

1966 • 170 citations

The dipole moment of the C—H bond

1942 • 162 citations

Hyperfine Structure of HD17O by Beam-Maser Spectroscopy

1969 • 136 citations

Atomic Hyperfine Structure. I. Polarization Wave Functions for the Ground States of B, C, N, O, and F

1968 • 111 citations

Improved Quantum Theory of Many-Electron Systems. III. The GF Method

1968 • 102 citations

Minimum Basis Wavefunctions for Water

1970 • 72 citations

Core Polarization and Hyperfine Structure of the B, C, N, O, and F Atoms

1969 • 69 citations

New Type of Wave Function for Li,<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">Be</mml:mi></mml:mrow><mml:mrow><mml:mo>+</mml:mo></mml:mrow></mml:msup></mml:mrow></mml:math>, and<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">B</mml:mi></mml:mrow><mml:mrow><mml:mo>+</mml:mo><mml:mo>+</mml:mo></mml:mrow></mml:msup></mml:mrow…

1968 • 61 citations

The molecular-orbital and equivalent-orbital approach to molecular structure

1957 • 55 citations

Improved Measurement of the Electric-Dipole Moment of the Hydroxyl Radical

1965 • 50 citations

Improved Quantum Theory of Many-Electron Systems. IV. Properties of GF Wavefunctions

1968 • 44 citations

Localized Molecular Orbitals for Ethane

1964 • 35 citations