Concepedia

Non-empirical calculations on the electronic spectrum of butadiene

Shing-Kuo Shih, Robert J. Buenker, Sigrid D. Peyerimhoff

Chemical Physics Letters · 1972 · 109 citations · 10 references

DOI

Concepts

References

10

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

Rudolph Pariser, Robert G. Parr · The Journal of Chemical Physics · 1953 · 1.6K citations

, , +16

Gaussian Lobe Function Expansions of Hartree—Fock Solutions for the First-Row Atoms and Ethylene

Jerry L. Whitten · The Journal of Chemical Physics · 1966 · 435 citations

, , +17

347. Magnetic perturbation of singlet–triplet transitions. Part IV. Unsaturated compounds

D. F. Evans · Journal of the Chemical Society (Resumed) · 1960 · 177 citations

, , +7

Combined SCF and CI Method for the Calculation of Electronically Excited States of Molecules: Potential Curves for the Low-Lying States of Formaldehyde

Robert J. Buenker, Sigrid D. Peyerimhoff · The Journal of Chemical Physics · 1970 · 138 citations

, , +17

The theoretical description of the (ππ*) excited states of ethylene

Thom H. Dunning, William J. Hunt, William A. Goddard · Chemical Physics Letters · 1969 · 123 citations

, , +12