Sa-PS2-Sy30
Log Number: P100
Abstract Submitted to the NT'02-Logo NANOTUBE'02 Workshop:

On the stability of SiOx based Nanotubes

G. Seifert1, Th. Koehler2, Th. Frauenheim2

1Institut f. Physikalische Chemie und Elektrochemie, TU Dresden, 01602 Dresden
2Theoretische Physik, Universitaet Paderborn, 33098 Paderborn
Contact e-mail: Gotthard.Seifert@chemie.tu-dresden.de

We report about the stability and the properties of novel SiOx-nanotubes and SiOx-Carbon composite nanotubes. Tubular structures of SiOx (x<2) are constructed by a conformal mapping of two-dimensional layer structures onto a surface of a cylinder. The stability of these tubes is investigated using density-functional based methods. Furthermore, possible decorations of carbon nanotubes with SiOx-layers are discussed. The different possibilities for the SiO-C interface in such nanocomposites are analysed. The results of the theoretical studies are compared with data of recent experimental investigations for such systems.

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