Natural Spin Orbital Analysis of Hydrogen Molecule Wave Functions

Quantum Theory of Many-Particle Systems. I. Physical Interpretations by Means of Density Matrices, Natural Spin-Orbitals, and Convergence Problems in the Method of Configurational Interaction

1955 • 3,424 citations

Wechselwirkung neutraler Atome und hom�opolare Bindung nach der Quantenmechanik

1927 • 1,778 citations

Natural Orbitals in the Quantum Theory of Two-Electron Systems

1956 • 648 citations

The Ground State of the Hydrogen Molecule

1933 • 609 citations

XXXIV. Notes on the molecular orbital treatment of the hydrogen molecule

1949 • 541 citations

The Problem of the Normal Hydrogen Molecule in the New Quantum Mechanics

1928 • 407 citations

The Normal State of the Hydrogen Molecule

1933 • 307 citations

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

1959 • 305 citations

The Quantum Theory of Valence

1935 • 303 citations

�ber die Eigenschaften des Wasserstoffmolek�ls im Grundzustande

1927 • 250 citations

The Energy of Interaction between Two Hydrogen Atoms

1950 • 204 citations

The Normal State of the Hydrogen Molecule

1931 • 191 citations

Correlation Splitting in Helium‐Like Ions

1956 • 153 citations

Self-consistent field for molecular hydrogen

1938 • 119 citations

The electrostatic calculation of molecular energies - II. Approximate wave functions and the electrostatic method

1954 • 115 citations

A One-Center Wave Function for the Hydrogen Molecule

1958 • 105 citations

On the Value of the Electric Quadrupole Moment of the Deuteron

1940 • 82 citations

Single-Center Wave Function for the Hydrogen Molecule

1959 • 59 citations

The Energy of the Hydrogen Molecule

1950 • 52 citations

Floating Wave Functions for H2+ and H2

1958 • 51 citations

Semilocalized Orbitals. I. The Hydrogen Molecule

1951 • 50 citations

Approximation of Molecular Orbitals in Diatomic Molecules by Diatomic Orbitals

1954 • 45 citations

The Electric Quadrupole Moment of the Deuteron

1950 • 42 citations

Quantum Mechanics of the H3 Complex

1958 • 33 citations

Configuration Interaction Applied to the Hydrogen Molecule

1955 • 21 citations

Approximate Natural Spin Orbitals for the Hydrogen Molecule

1959 • 14 citations

Molecular Orbitals for the Ground State of the H2 Molecule

1957 • 13 citations

Approximate diatomic orbitals for H2+

1957 • 7 citations

Configuration interaction in ground state of H2 molecule

1957 • 5 citations

Overlaps of Trial Functions for the Hydrogen Molecule. I. Ground-State Character of the 1s A.O. Approximations

1955 • 4 citations