Abstract
AbstractAlongside conventional domain‐averaged Fermi hole (DAFH) analysis in position space, we examine an alternative representation in momentum space. As examples, we consider the processes of splitting the chemical bonds in the simple diatomic molecules H2, N2, and LiH, as representatives of nonpolar single, nonpolar multiple, and polar bonding. We believe that the additional information provided by the complementary description in momentum space contributes to a better understanding of the phenomenon of chemical bonding. © 2009 Wiley Periodicals, Inc. Int J Quantum Chem, 2009
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