Infrared intensities of H3O+, H2DO+, HD2O+, and D3O+

Gaussian Basis Functions for Use in Molecular Calculations. I. Contraction of (9s5p) Atomic Basis Sets for the First-Row Atoms

1970 • 4,990 citations

Gaussian Basis Functions for Use in Molecular Calculations. III. Contraction of (10s6p) Atomic Basis Sets for the First-Row Atoms

1971 • 2,165 citations

Accuracy of AH_nequilibrium geometries by single determinant molecular orbital theory

1974 • 2,129 citations

Velocity-Modulated Infrared Laser Spectroscopy of Molecular Ions: The<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi>ν</mml:mi></mml:mrow><mml:mrow><mml:mn>1</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>Band of HC<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msup><mml:mrow><mml:mi mathvariant="normal">O</mml:mi></mml:mrow><mml:mrow><mml:mo>+</mml:mo></mml:mrow></mml:msup></mml:mrow…

1983 • 326 citations

SCF-CI studies of correlation effects on hydrogen bonding and ion hydration

1975 • 312 citations

A systematic theoretical study of harmonic vibrational frequencies: The ammonium ion NH4+ and other simple molecules

1980 • 182 citations

Velocity-modulated infrared laser spectroscopy of molecular ions: The ν1 band of HNN+

1983 • 89 citations

The inversion potential and rotation-inversion energy levels of H3O+ and CH3−

1982 • 54 citations

The molecular structure of H3O+ by the ab initio SCF method and with inclusion of correlation energy

1973 • 40 citations

The inclusion of high-order replacements in configuration interaction calculations. Application to H3O+ inversion barrier

1980 • 22 citations

Metal–nonmetal transition in copper–xenon system

1983 • 4 citations