We investigate the transport properties of a biphenyl-dithiol molecule sandwiched between electrodes made of metal Y (Y = Cu, Ag and Au) using the non-equilibrium Green's function method based on a density functional theory. The electrode metal Y has an influence on the coupling between the molecule and electrodes, and thus on the transmission peak height. For the transmission T(Y) at the Fermi energy, we obtain T(Cu)∼T(Ag)
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http://dx.doi.org/10.1088/0953-8984/21/6/064220 DOI Listing Publication Analysis
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