Ab initio calculations on intermolecular forces. II. An analysis of potential energy curves for HE… HF, He… H2O, H2… HF and H2 … H2O at large and intermediate distances

Gaussian-Type Functions for Polyatomic Systems. I

1965 • 4,930 citations

Gaussian-Type Functions for Polyatomic Systems. II

1969 • 3,222 citations

Pressure Broadening in the Microwave and Infra-Red Regions

1949 • 1,189 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

Many-Electron Theory of Atoms and Molecules. I. Shells, Electron Pairs vs Many-Electron Correlations

1962 • 523 citations

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

1968 • 291 citations

The theory of intermolecular forces in the region of small orbital overlap

1965 • 276 citations

Intermolecular Forces in the Region of Small Orbital Overlap

1967 • 245 citations

A non-empirical study of the hydrogen bond between peptide units

1970 • 215 citations

Charge-Overlap Effects. Dispersion and Induction Forces

1969 • 213 citations

Atomic Bethe-Goldstone Equations. I. The Be Atom

1967 • 200 citations

Many-Electron Theory of Atoms and Molecules. II

1962 • 182 citations

Interatomic correlation energy and the van der Waals attraction between two helium atoms

1971 • 156 citations

Ab InitioCalculation of the Helium-Helium<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mmultiscripts><mml:mrow><mml:mi>Σ</mml:mi></mml:mrow><mml:mrow><mml:mi>g</mml:mi></mml:mrow><mml:mrow /><mml:mrow /><mml:mrow><mml:mo>+</mml:mo></mml:mrow><mml:mprescripts /><mml:mrow /><mml:mrow><mml:mn>1</mml:mn></mml:mrow><mml:mrow /><mml:mrow /></mml:mmultiscripts></mml:mrow></mml:math>Potential at Intermediate and Large Separations

1970 • 145 citations

SCF-MO-LCGO studies on hydrogen bonding. The water dimer

1971 • 138 citations

Theory of long-range dispersion forces

1965 • 125 citations

Computed potential hypersurface (including electron correlation) of the system Li+/H2

1973 • 117 citations

Calculation of the Attractive He Pair Potential

1970 • 114 citations

Ab initio calculations on small hydrides including electron correlation

1970 • 105 citations

Study of the Electronic Structure of Molecules. I. Molecular Wavefunctions and Their Analysis

1967 • 101 citations

Interaction potential for He/H2 including the region of the van der waals minimum

1973 • 93 citations

An SCF partitioning scheme for the hydrogen bond

1970 • 89 citations

Impact Theory of the Noble-Gas-Broadened HCl Vibration-Rotation Lines

1963 • 89 citations

Hyperpolarizabilities of Some Polar Diatomic Molecules

1967 • 86 citations

Ab initio calculations on small hydrides including electron correlation

1973 • 74 citations

Stark Effect and Hyperfine Structure of Hydrogen Fluoride

1963 • 69 citations

Center of Dispersion Force in HCl Interacting with Rare-Gas Atoms

1966 • 65 citations

On the H+F2→HF+F reaction. An ab initio potential energy surface

1973 • 61 citations

Potential curve of the lowest triplet state of Li2

1972 • 61 citations

Electric polarizability of polyatomic molecules

1967 • 58 citations

Perturbation calculations on the hydrogen bonds between some first-row atoms

1971 • 53 citations

Theoretical prediction of the existence and properties of the lithium hydride dimer

1972 • 46 citations

The ionisation potentials of polyatomic molecules. I. Introduction and the ionisation potentials of H2O and H2S

1948 • 39 citations

AB initio calculations on intermolecular forces. The systems He…HF and He…H2O

1973 • 30 citations

Messungen des Depolarisationsgrades bei der molekularen Lichtzerstreuung

1935 • 30 citations

Potential curve of the Li2 ground state for large internuclear distances. A contribution to the understanding of interatomic forces

1970 • 27 citations

The long range intermolecular potential of H₂-H₂

1972 • 20 citations