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À propos de : Effects of Intermolecular Interaction and Molecule−Electrode Couplings on MolecularElectronic Conductance        

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  • Effects of Intermolecular Interaction and Molecule−Electrode Couplings on MolecularElectronic Conductance
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  • By applying nonequilibrium Green's function and first-principle calculation, we investigate the transportbehavior of a prototype of a molecular device. The intermolecular interaction and molecule−electrode couplingeffects are analyzed in detail, through which we can gain insight into the complexities within a moleculardevice such as intermolecular charge transport contributions and the imperfect molecule−electrode contact.The existing discrepancy between theory and experiment is discussed.
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