Hydrogen-hydrogen interaction in planar biphenyl: A theoretical study based on the interacting quantum atoms and Hirshfeld atomic energy partitioning methods

Investigation of the distinction between van der Waals interaction and chemical bonding based on the PAEM-MO diagram

(2014) Dong-Xia Zhao et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Bay-type H···H “bonding” in cis-2-butene and related species: QTAIM versus NBO description

(2014) Frank Weinhold et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Beyond the molecular orbital conception of electronically excited states through the quantum theory of atoms in molecules

(2014) David Ferro-Costas et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Characteristics of beryllium bonds; a QTAIM study

(2012) K. Eskandari   JOURNAL OF MOLECULAR MODELING

Do Nonbonded H--H Interactions in Phenanthrene Stabilize It Relative to Anthracene? A Possible Resolution to this Question and Its Implications for Ligands such as 2,2′-Bipyridyl

(2012) Robert D. Hancock et al.   JOURNAL OF PHYSICAL CHEMISTRY A

An Extension of the Hirshfeld Method to Open Shell Systems Using Fractional Occupations

(2011) D. Geldof et al.   Journal of Chemical Theory and Computation

Hydrogen–hydrogen bonding: A stabilizing interaction in strained chelating rings of metal complexes in aqueous phase

(2010) Ignacy Cukrowski et al.   CHEMICAL PHYSICS LETTERS

Kinetic energy density and covalent bonding – a complementary analysis at the border of bond and no bond

(2010) Heiko Jacobsen   DALTON TRANSACTIONS

Bond Paths Are Not Chemical Bonds

(2009) Richard F. W. Bader   JOURNAL OF PHYSICAL CHEMISTRY A