authors Geerlings, Paul Chamorro, Eduardo Chattaraj, Pratim Kumar De Proft, Frank Gázquez, José L Liu, Shubin Morell, Christophe Toro-Labbé, Alejandro Vela, Alberto Ayers, Paul
has subject area 0307 Theoretical and Computational Chemistry (FoR) Chemical Physics (Science Metrix)
keywords CDFT history CDFT issues CDFT philosophy CHEMICAL-REACTIVITY INDEXES Chemistry Chemistry, Physical Conceptual DFT (CDFT) Density Functional Theory (DFT) ELECTRONEGATIVITY EQUALIZATION METHOD ELECTRONIC-STRUCTURE PRINCIPLES FRACTIONAL PARTICLE NUMBER LINEAR-RESPONSE KERNEL MAXIMUM HARDNESS PRINCIPLE MINIMUM POLARIZABILITY PRINCIPLES MOLECULAR-ORBITAL THEORY Physical Sciences SUBSTITUTED FULVENE DERIVATIVES Science & Technology WOODWARD-HOFFMANN RULES