Wilfried Langenaeker

Atomic charges, dipole moments, and Fukui functions using the Hirshfeld partitioning of the electron density

Frank De Proft, Christian Van Alsenoy, Anik Peeters et al. · Journal of Computational Chemistry · 2002 · 273 citations

Engineering, Computational Chemistry, Chemistry +20

Ab initio determination of substituent constants in a density functional theory formalism: calculation of intrinsic group electronegativity, hardness, and softness

Frank De Proft, Wilfried Langenaeker, Paul Geerlings · The Journal of Physical Chemistry · 1993 · 191 citations

Engineering, Altmetric Attention Score, Intrinsic Group Electronegativity +16

Development of Local Hardness-Related Reactivity Indices: Their Application in a Study of the SE at Monosubstituted Benzenes within the HSAB Context

Wilfried Langenaeker, Frank De Proft, Paul Geerlings · The Journal of Physical Chemistry · 1995 · 155 citations

Engineering, Altmetric Attention Score, Bibliometrics +23

The Electronegativity Equalization Method I: Parametrization and Validation for Atomic Charge Calculations

Patrick Bultinck, Wilfried Langenaeker, Philippe Lahorte et al. · The Journal of Physical Chemistry A · 2002 · 135 citations

Engineering, Chemical Analysis, Organic Chemistry +21

Negative Fukui functions: New insights based on electronegativity equalization

Patrick Bultinck, Ramon Carbó‐Dorca, Wilfried Langenaeker · The Journal of Chemical Physics · 2003 · 131 citations · Full text

Organic Molecules, Engineering, Biochemistry +12