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Combined experimental and theoretical DFT study of molecular nanowires negative differential resistance and interaction with gold clusters

. 2005 Oct ; 18 (2) : 201-6. [epub] 20051021

Status PubMed-not-MEDLINE Language English Country France Media print-electronic

Document type Journal Article

Electric-field-assisted assembly has been used to place rod-shaped metal nanowires containing 4-[[2-nitro-4-(phenylethynyl) phenyl] ethynyl] benzenthiol molecules onto lithographically defined metal pads. These junctions exhibited negative differential resistance. The quantum chemical approach was used to compare the properties of Au-bonded 4-[[2-nitro-4-(phenylethynyl) phenyl] ethynyl] benzenthiol molecule and a molecule that does not exhibit the negative differential resistance, Au-bonded 4-[[4-(phenylethynyl) phenyl] ethynyl] benzenthiol. The influence of the static electric field and charge variation were modelled for both systems.

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