Natural or orthogonalized magnetic orbitals: Two alternative ways to describe the exchange interaction

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

Per‐Olov Löwdin · The Journal of Chemical Physics · 1950 · 3.2K citations

Natural Sciences, Chemistry, Physics +10

Orbital interactions in metal dimer complexes

P. Jeffrey Hay, Jack C. Thibeault, Roald Hoffmann · Journal of the American Chemical Society · 1975 · 1.3K citations

Natural Sciences, Chemistry, Inorganic Chemistry +15

Covalent bonding and magnetic properties of transition metal ions

J. Owen, J. H. M. Thornley · Reports on Progress in Physics · 1966 · 519 citations

Natural Sciences, Chemistry, Physics +17

Exchange interaction in roof-shaped hydroxo-bridged copper(II) dimers

Marie France Charlot, Olivier Kahn, S. Jeannin et al. · Inorganic Chemistry · 1980 · 92 citations

Natural Sciences, Chemistry, Electrochemistry +5

Valence-bond analysis of extended Hubbard models: Charge-transfer excitations of molecular conductors

S. Mazumdar, Z. G. Soos · Physical review. B, Condensed matter · 1981 · 91 citations

Natural Sciences, Chemistry, Physics +11