Physics – Condensed Matter – Mesoscale and Nanoscale Physics
Scientific paper
2010-01-14
Phys. Rev. B. 79, 195431 (2009)
Physics
Condensed Matter
Mesoscale and Nanoscale Physics
6 pages, 5 figures, 1 table
Scientific paper
10.1103/PhysRevB.79.195431
We have performed experiments on single-wall carbon nanotube (SWNT) networks and compared with density-functional theory (DFT) calculations to identify the microscopic origin of the observed sensitivity of the network conductivity to physisorbed O2 and N2. Previous DFT calculations of the transmission function for isolated pristine SWNTs have found physisorbed molecules have little influence on their conductivity. However, by calculating the four-terminal transmission function of crossed SWNT junctions, we show that physisorbed O2 and N2 do affect the junction's conductance. This may be understood as an increase in tunneling probability due to hopping via molecular orbitals. We find the effect is substantially larger for O2 than for N2, and for semiconducting rather than metallic SWNTs junctions, in agreement with experiment.
Morgan Ciara
Mowbray Duncan J.
Thygesen Kristian S.
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