On the solution of the quantum mechanical two-electron problem by direct calculation of the natural orbitals

Wechselwirkung neutraler Atome und hom�opolare Bindung nach der Quantenmechanik

1927 • 1,778 citations

Wave functions of the hydrogen molecular ion

1953 • 744 citations

Natural Orbitals in the Quantum Theory of Two-Electron Systems

1956 • 648 citations

The molecular orbital theory of chemical valency XVI. A theory of paired-electrons in polyatomic molecules

1953 • 434 citations

Extended Hartree—Fock Wavefunctions: Optimized Valence Configurations for H2 and Li2, Optimized Double Configurations for F2

1966 • 422 citations

Superposition of Configurations and Natural Spin Orbitals. Applications to the He Problem

1959 • 305 citations

Direct Determination of Natural Orbitals and Natural Expansion Coefficients of Many-Electron Wavefunctions. I. Natural Orbitals in the Geminal Product Approximation

1964 • 235 citations

Configuration Interaction in the Hydrogen Molecule—The Ground State

1960 • 141 citations

Die L�sung des quantenmechanischen Zwei-Elektronenproblems durch unmittelbare Bestimmung der nat�rlichen Einelektronenfunktionen

1963 • 137 citations

Natural Expansion of Exact Wavefunctions. II. The Hydrogen-Molecule Ground State

1962 • 132 citations

A One-Center Wave Function for the Hydrogen Molecule

1958 • 105 citations

The molecular orbital theory of chemical valency IX. The interaction of paired electrons in chemical bonds

1951 • 71 citations

The Nature of the Two-Electron Chemical Bond. III. Natural Orbitals for<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">H</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>

1963 • 68 citations

Single-Center Wave Function for the Hydrogen Molecule

1959 • 59 citations

Two-configuration, self-consistent field theory

1966 • 56 citations

Improved one-centre wave functions for the hydrogen and methane molecules

1963 • 52 citations

Molecular Orbital Studies of Diatomic Molecules. III. The Ground State of the Hydrogen Molecule

1963 • 43 citations

The two-configuration approximation for four-electron ions

1961 • 41 citations

Correlation Splitting in the Hydrogen Molecule

1962 • 38 citations

Optimum-Multiconfiguration Self-Consistent-Field Equations

1965 • 35 citations

On One-Center Expansions in H2+

1965 • 34 citations

R�solution du probl�me � deux �lectrons en m�canique quantique par d�termination directe des orbitales naturelles

1963 • 31 citations

One-Center Perturbation Approach to Molecular Electronic Energies. II. Exact Wavefunctions and Energies for H2+-Like Molecular Puffs

1965 • 24 citations

Improvement of One-Center Wavefunctions over Small Regions

1964 • 16 citations