![Application of Xα multiple-scattering theory to planar organic molecules: One-electron properties and ionization potentials of benzene, pyridine, pyrazine, pyrrole, and imidazole]()
Application of Xα multiple-scattering theory to planar organic molecules: One-electron properties and ionization potentials of benzene, pyridine, pyrazine, pyrrole, and imidazoleCase, David A.; Cook, Michael; Karplus, Martin · The Journal of Chemical Physics · 1980