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Register a new userElectron Interference Effects on the Conductance of Doped Carbon Nanotubes
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We investigate the effects of impurity scattering on the conductance of metallic carbon nanotubes as a function of the relative separation of the impurities. First we compute the conductance of a clean (6,6) tube, and the effect of model gold contacts on this conductance. Then, we compute the effect of introducing a single, two, and three oxygen atom impurities. We find that the conductance of a single-oxygen-doped (6,6) nanotube decreases by about 30 % with respect to that of the perfect nanotube. The presence of a second doping atom induces strong changes of the conductance which, however, depend very strongly on the relative position of the two oxygen atoms. We observe regular oscillations of the conductance that repeat over an O-O distance that corresponds to an integral number of half Fermi-wavelengths ($mlambda_F/2$). These fluctuations reflect strong electron interference phenomena produced by electron scattering from the oxygen defects whose contribution to the resistance of the tube cannot be obtained by simply summing up their individual contributions.
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We have calculated the effects of structural distortions of armchair carbon nanotubes on their electrical transport properties. We found that the bending of the nanotubes decreases their transmission function in certain energy ranges and leads to an increased electrical resistance. Electronic structure calculations show that these energy ranges contain localized states with significant $sigma$-$pi$ hybridization resulting from the increased curvature produced by bending. Our calculations of the contact resistance show that the large contact resistances observed for SWNTs are likely due to the weak coupling of the NT to the metal in side bonded NT-metal configurations.
We use DFT to study the effect of molecular adsorbates on the conductance of metallic carbon nanotubes. The five molecules considered (NO2, NH2, H, COOH, OH) lead to similar scattering of the electrons. The adsorption of a single molecule suppresses one of the two available channels of the CNT at low bias conductance. If more molecules are adsorbed on the same sublattice, the remaining open channel can be blocked or not, depending on the relative position of the adsorbates. If a simple geometric condition is fulfilled this channel is still open, even after adsorbing an arbitrary number of molecules.
A single-wall carbon nanotube possesses two different types of plasmons specified by the wavenumbers in the azimuthal and axial directions. The azimuthal plasmon that is caused by interband transitions has been studied, while the effect of charge doping is unknown. In this paper, we show that when nanotubes are heavily doped, intraband transitions cause the azimuthal plasmons to appear as a plasmon resonance in the near-infrared region of the absorption spectra, which is absent for light doping due to the screening effect. The axial plasmons that are inherent in the cylindrical waveguide structures of nanotubes, account for the absorption peak of the metallic nanotube observed in the terahertz region. The excitation of axial (azimuthal) plasmons requires a linearly polarized light parallel (perpendicular) to the tubes axis.
Effect of contact interfaces, between metallic single-wall carbon nanotubes (SWCNT) and external electrodes made also of nanotubes, on the electrical conductance is studied. A tight-binding model with both diagonal and off-diagonal disorder, a recursive Green function technique as well as the Landauer formalism are used. The studies are carried out within the coherent transport regime and are focused on: (i) evolution from conductance quantization to resonant tunneling, (ii) SWCNTs length effects and (iii) magnetoresistance. It is shown that the so-called on-resonance devices, i.e. nanotubes having a conductance peak at the Fermi energy, occur with a period of 3 carbon inter-ring spacings. Additionally, the present approach provides an insight into magnetoresistance dependence of SWCNTs on conditions at the contact interface.
The localization length and density of states of carbon nanotubes are evaluated within the tight-binding approximation. By comparison with the corresponding results for the square lattice tubes, it is found that the hexagonal structure affects strongly the behaviors of the density of states and localization lengths of carbon nanotubes.
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