Toward an Understanding of Potential-Energy Functions for Diatomic Molecules

Electronic Population Analysis on LCAO–MO Molecular Wave Functions. I

1955 • 10,259 citations

Spectra of diatomic molecules

1950 • 5,975 citations

Quantum Theory of Molecules and Solids

1951 • 1,912 citations

Potential-Energy Curves for the X 1Σg+, b3Σu+, and C 1Πu States of the Hydrogen Molecule

1965 • 1,371 citations

A Relation Between Internuclear Distances and Bond Force Constants

1934 • 998 citations

The Physical Nature of the Chemical Bond

1962 • 880 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

Criteria for the Construction of Good Self-Consistent-Field Molecular Orbital Wave Functions, and the Significance of LCAO-MO Population Analysis

1962 • 608 citations

Molecular Charge Distributions and Chemical Binding

1967 • 485 citations

Comparative Study of Potential Energy Functions for Diatomic Molecules

1957 • 477 citations

A Relation between Bond Force Constants, Bond Orders, Bond Lengths, and the Electronegativities of the Bonded Atoms

1946 • 460 citations

Studies in Molecular Structure. II. LCAO-MO-SCF Wave Functions for Selected First-Row Diatomic Molecules

1960 • 399 citations

Das Eigenschwingungsspektrum zweiatomiger Moleküle in der Undulationsmechanik

1926 • 165 citations

Theoretical Interpretation of Force Constants

1963 • 141 citations

New regularities in vibrational spectra

1946 • 80 citations

The relation between potential energy and interatomic distance in some diatomic molecules

1940 • 70 citations

Zum Aufbau der Bandenspektra

1925 • 63 citations

Chemical Binding and Potential-Energy Functions for Molecules

1967 • 60 citations

The Possible Existence of a Reduced Potential Energy Function for Diatomic Molecules¹

1954 • 60 citations

Derivation of an Internuclear Potential Function from a Quantum Mechanical Model

1955 • 57 citations

XLIII.The relation between vibration frequency and nuclear separation for some simple non-hydride diatomic molecules

1934 • 57 citations

Construction of Reliable Internuclear Potential Curves from Equilibrium Bond Lengths and Vibrational Frequencies

1961 • 56 citations

Prediction of Interatomic Distances and Force Constants in Diatomic Hydrides

1950 • 54 citations

The application of perturbation theory to the calculation of force constants

1960 • 53 citations

A free-electron theory of conjugated molecules

1953 • 52 citations

General Relation between Potential Energy and Internuclear Distance for Diatomic Molecules. III. Excited States

1961 • 50 citations

The Determination of Internuclear Distances and of Dissociation Energies from Force Constants

1940 • 44 citations

The relation between potential energy and interatomic distance in some di-atomic molecules II

1942 • 42 citations

Application of the Hellmann—Feynman and Virial Theorems to the Theoretical Calculation of Molecular Potential Constants

1966 • 37 citations

Electronic Bases of Molecular Vibrations. I. General Theory for Diatomic Molecules

1963 • 36 citations

Diatomic Forces and Force Constants. I. Errors in the Hellmann—Feynman Method

1966 • 34 citations

Forces in Molecules. II. A Differential Equation for the Potential-Energy Function

1963 • 27 citations

Reduced potential curves of first-row diatomic molecules

1963 • 25 citations

On the Validity of the Reduced Potential Curve (RPC) Method

1967 • 25 citations

Studies in Molecular Structure. III. Populations Analyses for Selected First-Row Diatomic Molecules

1961 • 25 citations

The assignment of quantum numbers for electrons in molecules. Extracts from Phys. Rev. 32, 186–222 (1928), plus currently written annotations

1967 • 24 citations

Ground-State Potential Energy of Diatomic Molecules

1962 • 21 citations

Ein 3-dimensionales FE-Modell der chemischen Bindung

1965 • 17 citations

New Potential Energy Function. II. Theoretical

1962 • 16 citations

Force Constants of Diatomic Molecules. I. A General Semitheoretical Approach

1967 • 15 citations

Three‐Dimensional FE‐MO Model. I. ΔH of Dissociation of Homonuclear Diatomic Molecules

1961 • 14 citations

``Smoothed Potential'' Theory of Chemical Binding

1956 • 12 citations

Electronic Bases of Molecular Vibrations. II. Generalized Energy Theorems and the Force Constants of Polyatomic Molecules

1966 • 12 citations

Force Curves for Excited Electronic States

1960 • 10 citations

Electronic Bases of Molecular Vibrations. III. Ab Initio Calculations of H2+ and H2 Force Constants

1966 • 9 citations

New Force Theorem

1966 • 5 citations

Calculations of Higher-Order Spectroscopic Parameters Using Empirical Potential Functions

1963 • 4 citations

Forces in Molecules. III. Analysis of an Empirical Potential Function

1963 • 3 citations