Substituents role in zinc phthalocyanine derivatives used as dye-sensitized solar cells. A theoretical study using Density Functional Theory 

Improvement of photovoltaic performance by substituent effect of donor and acceptor structure of TPA-based dye-sensitized solar cells 

Unraveling the nature of the catalytic power of fluoroacetate dehalogenase 

Electronic and optical properties of metalloporphyrins of zinc on TiO2 cluster in dye sensitized solar cells (DSSC). A quantum chemistry study 

Tailoring electroactive surfaces by non template molecular assembly. Towards electrooxidation of L-cysteine 

Interaction of YD2 and TiO2 in dye-sensitized solar cells (DSSCs): a density functional theory study 

Theoretical exploration of seleno and tellurophenols as promising alternatives to sulfur ligands for anchoring to gold (111) materials 

Calculations of the light absorption spectra of porphyrinoid chromophores for dye-sensitized solar cells† 

Theoretical study of the protonation of [Pt3(μ-L) 3(L′)3] (L = CO, SO2, CNH; L′ = PH3, CNH) 

Theoretical study of complexes of the type [Pt3(M-L) 3(L')3]-X (L=CO, SO2,CNH; L'=PH 3,CNH; X=Tl+, Hg0, MPH3+ (M = Cu, Au, Ag))