Prediction of metallic nanotube reactivity for H2O activation

The reactivity of metallic nanotubes toward the catalysis of water dissociation, a key step in the water gas shift reaction (WGSR), was analyzed from density functional theory (DFT) calculations.

Theoretical analysis of hot electron injection from metallic nanotubes into a semiconductor interface

Hot electron injection from a metallic nanotube under optical illumination into a semiconductor layer in contact with its inner boundary.