Bent bonds, hybridization, and the maximum localization criterion

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

Atomic Screening Constants from SCF Functions

E. Clementi, D. L. Raimondi · The Journal of Chemical Physics · 1963 · 2.4K citations

Natural Sciences, Chemistry, Physics +17

The Physical Nature of the Chemical Bond

Klaus Ruedenberg · Reviews of Modern Physics · 1962 · 924 citations

Natural Sciences, Chemistry, Physics +17

The density matrix in many-electron quantum mechanics I. Generalized product functions. Factorization and physical interpretation of the density matrices

R. McWeeny · Proceedings of the Royal Society of London A Mathematical and Physical Sciences · 1959 · 402 citations

Natural Sciences, Physics, Quantum Chemistry +16

The Chemical Society

Walter Noel Hartley · Nature · 1876 · 299 citations · Full text