4.8 Article

First-principles theory of correlated transport through nanojunctions

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PHYSICAL REVIEW LETTERS
卷 94, 期 11, 页码 -

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AMER PHYSICAL SOC
DOI: 10.1103/PhysRevLett.94.116802

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We report the inclusion of electron-electron correlation in the calculation of transport properties within an ab initio scheme. A key step is the reformulation of Landauer's approach in terms of an effective transmittance for the interacting electron system. We apply this framework to analyze the effect of shortrange interactions on Pt atomic wires and discuss the coherent and incoherent correction to the mean-field approach.

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