Ab Initio AMO Calculation of the Lowest Singlet–Triplet Separation in Benzene

New Developments in Molecular Orbital Theory

1951 • 5,347 citations

Self-Consistent Field Theory for Open Shells of Electronic Systems

1960 • 1,927 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

Single determinant wave functions

1961 • 633 citations

The Thermodynamics and Molecular Structure of Benzene and Its Methyl Derivatives¹

1943 • 349 citations

Alternant molecular orbital method

1967 • 277 citations

Studies in Molecular Structure. I. Scope and Summary of the Diatomic Molecule Program

1960 • 234 citations

Vibronic—Spin-Orbit Perturbations and the Assignment of the Lowest Triplet State of Benzene

1963 • 232 citations

On the Pi-Electron Approximation and Its Possible Refinement

1956 • 216 citations

Paramagnetic resonance in phosphorescent aromatic hydrocarbons

1963 • 177 citations

Study of the Electronic Structure of Molecules. III. Pyrrole Ground-State Wavefunction

1967 • 145 citations

Barrier to Internal Rotation in Ethane

1966 • 113 citations

Ab Initio SCF MO and CI Calculations on the Electronic Spectrum of Benzene

1968 • 93 citations

Singlet—Triplet Transitions in p-Dihalogenated Benzenes

1967 • 87 citations

Determination of the Assignment of Triplet States in Catacondensed Aromatic Hydrocarbons

1962 • 78 citations

Preliminary Results of a Self-Consistent-Field Study of the Benzene Molecule

1965 • 70 citations

Benzene and Its Ionized States

1967 • 59 citations

Relativistic Corrections in Many-Electron Systems

1960 • 46 citations

Pi Electronic Structure of the Benzene Molecule

1963 • 44 citations

Electronic States of Benzene by Photoselection. The Polarization of Luminescence in Benzene, Perdeuterobenzene, and Perchlorobenzene

1964 • 43 citations

The Method of Different Orbitals for Different Spins and Its Application to Alternant Hydrocarbons

1963 • 40 citations

Molecular Distortions and the Phosphorescence of Benzene

1969 • 40 citations

Sigma and Pi Electronic Reorganization in Acetylene

1967 • 28 citations

Studies on the Alternant Molecular Orbital Method. V. A Many-Parameter Energy Expression for States with Different Multiplicities; Application to Benzene

1963 • 27 citations