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期刊论文

Electrical conductance of DNA molecules with varied density of itinerant π electrons

解士杰Tuan Gao Xue Fu Liang-Mo Mei and Shi-Jie Xiea

J. Chem. Phys. 124, 234702 2006 ,-0001,():

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摘要/描述

The electrical transport of DNA is closely related to the density of itinerant π electrons because of the strong electron-lattice interaction. The resistivities of two typical DNA molecules [poly(dG)-poly(dC) and λ-DNA] with varied densities of itinerant π electrons are calculated. It is found that the dependence of the resistivity on the density of itinerantπelectrons is symmetrical about the half-filling state of itinerant π electrons in poly(dG)-poly(dC). At the half-filling state, the Peierls phase transition takes place and poly(dG)-poly(dC) has a large resistivity. When the density of itinerant π electrons departs far from the half-filling state, the resistivity of poly(dG)-poly(9dC) becomes small. Forλ-DNA, there is no Peierls phase transition due to the aperiodicity of its base pair arrangement. The resistivity of poly(dG)-poly(dC) decreases with increasing length of the molecular chain, but the resistivity of λ-DNA increases with increasing length. The conducting mechanisms for poly(dG)-poly(dC) and a few λ-DNA molecules with varied densities of itinerantπelectrons are analyzed.

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