Self-consistent molecular orbital methods. XXIII. A polarization-type basis set for second-row elements

The influence of polarization functions on molecular orbital hydrogenation energies

1973 • 14,592 citations

Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules

1971 • 9,621 citations

Contracted Gaussian basis sets for molecular calculations. I. Second row atoms, Z=11–18

1980 • 8,859 citations

Self-Consistent Molecular-Orbital Methods. I. Use of Gaussian Expansions of Slater-Type Atomic Orbitals

1969 • 4,043 citations

Self-consistent molecular orbital methods. 21. Small split-valence basis sets for first-row elements

1980 • 3,758 citations

Methods of Electronic Structure Theory

1977 • 2,725 citations

The isomers of silacyclopropane

1980 • 1,751 citations

Contribution of triple substitutions to the electron correlation energy in fourth order perturbation theory

1980 • 1,192 citations

Self-Consistent Molecular Orbital Methods. IV. Use of Gaussian Expansions of Slater-Type Orbitals. Extension to Second-Row Molecules

1970 • 689 citations

Self-consistent molecular orbital methods. XVII. Geometries and binding energies of second-row molecules. A comparison of three basis sets

1976 • 617 citations

Electronic Structure of N2, CO, and BF

1964 • 286 citations

Analytic Self-Consistent Field Wavefunctions and Computed Properties for Homonuclear Diatomic Molecules

1964 • 226 citations

Effect of electron correlation on theoretical equilibrium geometries

1979 • 211 citations

A systematic preparation of new contracted Gaussian‐type orbital sets. V. From Na through Ca

1981 • 120 citations

Molecular orbital theory of the properties of inorganic and organometallic compounds. 1. STO-NG basis sets for third-row main-group elements

1980 • 118 citations

A systematic preparation of new contracted Gaussian‐type orbital sets. VI. Ab initio calculation on molecules containing Na through Cl

1981 • 73 citations

Molecular orbital theory of the properties of inorganic and organometallic compounds. 2. STO-NG basis sets for fourth-row main-group elements

1981 • 63 citations

The equilibrium structure and rotational constant of HCC+

1979 • 28 citations

Economical geometry optimization in first row molecules with bond function augmented basis sets

1977 • 18 citations