Enhancement of the catalytic activity of fe phthalocyanine for the reduction of O 2 anchored to Au(111) via conjugated self-assembled monolayers of aromatic thiols as compared to Cu phthalocyanine 

Surface on Surface. Survey of the Monolayer Gold-Graphene Interaction from Au12 and PAH via Relativistic DFT Calculations 

Theoretical study on electronic spectra and aurophilic attraction in [Au3 (MeN {double bond, long} COMe)3]n (n = 1 s(-) 4) complexes 

Mixed gold(I)-gold(III) complexes with bridging selenido ligands. Theoretical studies of the gold(I)-gold(III) interactions 

Theory of d 10 - d 10 Closed-Shell Attraction. III. Rings 

Computational studies of the metal-binding site of the wild-type and the H46R mutant of the copper, zinc superoxide dismutase 

Theoretical insights into the adsorption of neutral, radical and anionic thiophenols on gold(111) 

A detailed study of the vapochromic behavior of {TI[Au(C6Cl 5)2]}n 

The electronic chemical potential as a basis for a cluster model approximation for intercalation of Li in 1T - TiS2 

Theoretical study of the d10-s2 interaction between Au(I) and Tl(I) in the [AuCl(PH3)2]Tl+ hypothetical complex