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First Principles Calculation of Universal Conductance Fluctuation in Monatomic Metal Chains

Chen Jing-Zhe1, Zhang Jin1 and Han Ru-Shan1

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Combining the non-equilibrium Green's function method and density functional theory, we provide a first-principle scheme to calculate the universal conductance fluctuation (UCF) in quasi one-dimensional monatomic chains subject to a magnetic field. Our results show that for these monatomic chains, the amplitude of the UCF is much smaller than the previous theoretical prediction for mesoscopic conductors by Lee et al. [Phys. Rev. Lett. 55 (1985) 1622; Phys. Rev. B 35 (1987) 1039] The reason is that the ergodic hypothesis fails in these nanowires due to the confinement of geometry. We ascribe the phenomenon to the flux-dependent density of states fluctuation.


PACS

71.15.Mb Density functional theory, local density approximation, gradient and other corrections

72.15.Gd Galvanomagnetic and other magnetotransport effects

72.15.Lh Relaxation times and mean free paths

72.15.Eb Electrical and thermal conduction in crystalline metals and alloys

71.20.Dg Alkali and alkaline earth metals

Subjects

Condensed matter: electrical, magnetic and optical

Dates

Issue 3 (March 2008)

Received 7 October 2007



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