To what extent can a heterometallic chain of transition metal ions generate an asymmetric current–voltage response? Density functional theory suggests that the answer depends very much on the symmetry of the dominant conduction channel: π channels are more localised and hence afford higher rectification ratios.
D. DeBrincat, O. Keers and J. E. McGrady, Chem. Commun., 2013, 49, 9116 DOI: 10.1039/C3CC45063E
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