Semiempirical Calculation on the Lower Electronic States of the Benzene Molecule

A Semi-Empirical Theory of the Electronic Spectra and Electronic Structure of Complex Unsaturated Molecules. I.

1953 • 1,947 citations

A Semi-Empirical Theory of the Electronic Spectra and Electronic Structure of Complex Unsaturated Molecules. II

1953 • 1,620 citations

A Relation Between Internuclear Distances and Bond Force Constants

1934 • 998 citations

The Relation Between the Internuclear Distances and Force Constants of Molecules and Its Application to Polyatomic Molecules

1935 • 668 citations

The electronic structure of some polyenes and aromatic molecules. VII. Bonds of fractional order by the molecular orbital method

1939 • 553 citations

Calculations of the Lower Excited Levels of Benzene

1938 • 498 citations

An Improvement in the π-Electron Approximation in LCAO MO Theory

1953 • 351 citations

Molecular Orbital Calculations of the Lower Excited Electronic Levels of Benzene, Configuration Interaction Included

1950 • 246 citations

Analysis of the Near Ultraviolet Electronic Transition of Benzene

1939 • 180 citations

HIGH RESOLUTION RAMAN SPECTROSCOPY OF GASES: II. ROTATIONAL SPECTRA OF C₆H₆ AND C₆D₆, AND INTERNUCLEAR DISTANCES IN THE BENZENE MOLECULE

1954 • 170 citations

Atomic Valence States and Chemical Binding

1954 • 119 citations

Importance of Doubly Excited Configurations in the Interpretation of Electronic Spectra

1956 • 108 citations

Electronic Spectra and Structure of the Carbonyl Group

1957 • 105 citations

Configurational Interaction in Simple Molecular Orbital Theory

1954 • 83 citations

Theory of Electronic Excitation and Reorganization in the Formaldehyde Molecule

1960 • 61 citations

On the Method of Atoms in Molecules II: An Intra-Atomic Correlation Correction

1956 • 51 citations

Electronic States of para-Benzoquinone. I. Calculation of the Energy Levels by a Semi-empirical Molecular Orbital Method Neglecting Configuration Interaction

1957 • 48 citations

The Ultraviolet Absorption of Simple Hydrocarbons IV. Unsaturated Cyclic Hydrocarbons in the Schumann Region

1938 • 42 citations

Semiempirical Calculation on the Electronic Structure of the Nitrogen-Containing Heterocyclic Molecules. I. General Theory

1958 • 41 citations

Role of Atomic Valence States in Molecular Energy Calculations

1958 • 35 citations

Note on the Ultraviolet Absorption Systems of Benzene Vapor

1940 • 31 citations

Electronic States of Para-Benzoquinone. II. Calculation of the Energy Levels by a Semiempirical Molecular Orbital Method Including Configuration Interaction

1957 • 30 citations

Polar structures in the theory of conjugated molecules III. The energy levels of benzene

1950 • 26 citations

Calculations of the Lower Excited Levels of Benzene

1949 • 24 citations

Calculation on the Electronic States of the Formaldehyde Molecule by a Semiempirical Molecular Orbital Method

1957 • 22 citations

Calculations of the lower excited electronic energy levels of cyclo butadiene and benzene

1953 • 21 citations

Semiempirical Calculation on the Electronic Structure of the Nitrogen-Containing Heterocyclic Molecules. II. Electronic Structure of Pyrazine with Particular Reference to Its n—π Transition

1958 • 20 citations

Molecular Orbital Calculations of Vibrational Force Constants. II. The Ring-Twisting Constants of Benzene

1949 • 18 citations

The intensity of the A 1g -E 1u transition in benzene

1951 • 17 citations

Refined Antisymmetric Molecular-Orbital Calculations of the Energy Levels of Benzene and Hexamethylbenzene

1959 • 9 citations

Calculation on the Changes of Vibrational Frequencies due to Electronic Excitation in Several Organic Molecules

1956 • 7 citations