Scattering Model of Molecular Electronic Structure
Phys. Rev. Lett. 22, 1168 – Published 2 June, 1969Erratum Phys. Rev. Lett. 23, 62 (1969)
DOI: https://doi.org/10.1103/PhysRevLett.22.1168
Abstract
A multiple-scattering model for calculating molecular orbitals has been applied with reasonable success to several elementary diatomic molecules. These results, together with the flexibility and computational simplicity of the model, suggest that it will be a practical new approach to the theoretical electronic structures of complex, polyatomic molecules.
Erratum
Scattering Model of Molecular Electronic Structure
Phys. Rev. Lett. 23, 62 (1969)