Ketene in a Gaussian Basis: LCAO–MO–SCF Wavefunction, One-Electron Properties, and Electron-Density Maps

New Developments in Molecular Orbital Theory

1951 • 5,347 citations

A Quantum Variational Calculation for HCHO

1960 • 166 citations

One-Electron Properties of Near-Hartree–Fock Wavefunctions. II. HCHO, CO

1969 • 157 citations

10 Reactions with organic compounds

1996 • 132 citations

Molecular g-Value Tensor, the Molecular Susceptibility Tensor, and the Sign of the Electric Dipole Moment in Formaldehyde

1968 • 110 citations

The Microwave Spectrum of Ketene

1952 • 82 citations

Experimental Determination of the Field Gradient at the Deuteron in Formaldehyde

1964 • 68 citations

Experimental Study of the Nuclear-Quadrupole and Spin—Rotation Interactions of 17O in Formaldehyde

1965 • 65 citations

13C Spin—Rotation Interaction and Magnetic Shielding at the Carbon and Oxygen Nuclei in Formaldehyde

1966 • 58 citations

Molecular Magnetic Moments and Susceptibility in Formaldehyde

1965 • 47 citations

Localized Orbitals. I. σ Bonds

1968 • 32 citations

Formaldehyde Molecule in a Gaussian Basis. A Self-Consistent Field Calculation

1968 • 30 citations

Formaldehyde Molecule in a Gaussian Basis. One-Electron Properties

1968 • 19 citations

Molecular g Values and Paramagnetic Susceptibility of Ketene

1968 • 17 citations

Hydrogen Spin—Spin, Spin—Rotation, and Deuterium Nuclear Quadrupole Interactions in Ketene, Ketene-d1, and Ketene-d2

1966 • 13 citations

Microwave Spectrum, Structure, and Quadrupole Coupling Constants of Spiropentyl Chloride

1966 • 9 citations

Field Gradient and Magnetic Shielding at the Deuteron (Proton) in Ketene

1965 • 8 citations