DFT Investigation of H<sub>2</sub> Activation by [M(NHPnPr<sub>3</sub>)('S3')] (M = Ni, Pd). Insight into Key Factors Relevant to the Design of Hydrogenase Functional Models
Autores:Giuseppe Zampella, Luca De Gioia, Piercarlo Fantucci, Maurizio Bruschi