Complex-band structure: A method to determine the off-resonant electron transport in oligomers

Research output: Contribution to journalArticlepeer-review

Abstract

We validate that off-resonant electron transport across ultra-short oligomer molecular junctions is characterised by a conductance which decays exponentially with length, and we discuss a method to determine the damping factor via the energy spectrum of a periodic structure as a function of complex wavevector. An exact mapping to the complex wavevector is demonstrated by first-principle-based calculations of: (a) the conductance of molecular junctions of phenyl-ethynylene wires covalently bonded to graphitic ribbons as a function of the bridge length, and (b) the complex-band structure of poly-phenyl-ethynylene.

Original languageEnglish
Pages (from-to)268-273
Number of pages6
JournalChemical Physics Letters
Volume389
Issue number4-6
DOIs
Publication statusPublished - 11 May 2004
Externally publishedYes

Fingerprint

Dive into the research topics of 'Complex-band structure: A method to determine the off-resonant electron transport in oligomers'. Together they form a unique fingerprint.

Cite this