Varadwaj, Pradeep R.; Cukrowski, Ignacy; Marques, Helder M.
(Elsevier, 2009)
To rationalize the influence of molecular architecture on metal ion selectivity and affinity, a DFT study of three amino-alcohol ligands, bis(2-hydroxyethyl)-ethane-1,2-diamine (BHEEN), and two ligands where the backbone ...