Chemical sensors based on individual single-walled carbon nanotubes (SWNTs) are demonstrated. Upon exposure to gaseous molecules such as NO(2) or NH(3), the electrical resistance of a semiconducting SWNT is found to dramatically increase or decrease. This serves as the basis for nanotube molecular sensors. The nanotube sensors exhibit a fast response and a substantially higher sensitivity than that of existing solid-state sensors at room temperature. Sensor reversibility is achieved by slow recovery under ambient conditions or by heating to high temperatures. The interactions between molecular species and SWNTs and the mechanisms of molecular sensing with nanotube molecular wires are investigated.

Arrays of electrical devices with each comprising multiple single-walled carbon nanotubes (SWNT) bridging metal electrodes are obtained by chemical vapor deposition (CVD) of nanotubes across prefabricated electrode arrays. The ensemble of nanotubes in such a device collectively exhibits large electrical conductance changes under electrostatic gating, owing to the high percentage of semiconducting nanotubes. This leads to the fabrication of large arrays of low-noise electrical nanotube sensors with 100% yield for detecting gas molecules. Polymer functionalization is used to impart high sensitivity and selectivity to the sensors. Polyethyleneimine coating affords n-type nanotube devices capable of detecting NO 2 at less than 1 ppb (parts-per-billion) concentrations while being insensitive to NH 3 . Coating Nafion (a polymeric perfluorinated sulfonic acid ionomer) on nanotubes blocks NO 2 and allows for selective sensing of NH 3 . Multiplex functionalization of a nanotube sensor array is carried out by microspotting. Detection of molecules in a gas mixture is demonstrated with the multiplexed nanotube sensors.

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Recently great advances have been made in demonstrating the viability of using carbon nanotubes (CNTs) to detect the presence of chemical gases such as NO 2 , NH 3 , and O 2 , and they have led to the design of a new breed of sensor devices. Based on intrinsic CNTs, the devices are capable of detecting small concentration of molecules with high sensitivity under ambient conditions. However, these devices have a limitation that only molecules binding to a carbon nanotube can be detected. They are currently limited to NH 3 , NO 2 , and O 2 , and a host of highly toxic gases (such as carbon monoxide), water molecules, and biomolecules cannot be detected using these intrinsic CNT devices. Recent efforts on externally functionalizing CNT surface and internal doping in CNT only result in temporary sensing capability due to the weak van der Waals interaction between CNT and doped materials. In this paper, we propose the concept of a new type of nanoscale sensor devices that can detect the presence of CO and water molecules. To overcome the reliability problem, these devices are developed by substitutional doping of impurity atoms (such as boron, nitrogen atoms) into intrinsic single-wall carbon nanotubes or by using composite B x C y N z nanotubes. Using first-principle calculations, we demonstrate that these sensor devices can not only detect the presence of CO and water molecules, but also the sensitivity of these devices can be controlled by the doping level of impurity atoms in a nanotube.

The possibility of modifying the electronic properties of nanotubes using gas molecule adsorption is investigated using the first-principles total energy density functional calculations. Detailed analysis of the electronic structures and energetics is performed for the semiconducting (10,0) single-walled carbon nanotube interacting with several representative gas molecules (NO2, NH3, CO, O2, and H2O). The results elucidate the mechanisms of the adsorption-induced nanotube doping and illustrate an example of the simulation-based design characterization of nanoelectronic components.