Atom and Bond Fukui Functions and Matrices: A Hirshfeld-I Atoms-in-Molecule Approach
Oña, Ofelia B., De Clercq, Olivier, Alcoba, Diego R., Torre, Alicia, Lain, Luis, Van Neck, Dimitri, Bultinck, PatrickLanguage:
english
Journal:
ChemPhysChem
DOI:
10.1002/cphc.201600433
Date:
July, 2016
File:
PDF, 1.20 MB
english, 2016