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The effect of the choice of parameters on the order of energy levels of benzene calculated in the π-electron approximation by the configuration interaction method including double- and triple-excited configurations

Data up to Jan 2025

Published1964
Citations61
References14

Total Citations Per Year

Abstract

References (14)

On the Non-Orthogonality Problem Connected with the Use of Atomic Wave Functions in the Theory of Molecules and Crystals

1950 • 2,996 citations

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

Electronic Structure and Spectra of Nitrogen Heterocycles

1957 • 1,211 citations

Theory of the Electronic Spectra and Structure of the Polyacenes and of Alternant Hydrocarbons

1956 • 1,052 citations

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

1962 • 523 citations

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

1950 • 246 citations

Importance of Doubly Excited Configurations in the Interpretation of Electronic Spectra

1956 • 108 citations

The valence-bond theory of molecular structure - III. Cyclo butadiene and benzene

1955 • 105 citations

Low Resolution Electronic Spectrum of Crystalline para-Dimethoxybenzene with Application to Benzene

1955 • 48 citations

Pi Electronic Structure of the Benzene Molecule

1963 • 44 citations

Pariser—Parr Calculations and Electro-Optical Effects in Benzene

1964 • 37 citations

Symmetry of the Second Excited Singlet State of Benzene

1955 • 27 citations

Semiempirical Calculation on the Lower Electronic States of the Benzene Molecule

1963 • 18 citations

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The effect of the choice of parameters on the order of energy levels of benzene… (1964) – Theoretica Chimica Acta | Metascience Observatory Explorer