Jp Tollenaere

The Electronegativity Equalization Method II: Applicability of Different Atomic Charge Schemes

Patrick Bultinck, Philippe Lahorte, Paul Geerlings, 2002 .

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

Michel Waroquier, Patrick Bultinck, Philippe Lahorte, 2002 .