Propriendades Estruturais E Mecanicas
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1. Study of the influence of structural defects in the properties of carbon nanotube / Estudo da influência de defeitos estruturais nas propriedades de nanotubos de carbono
We have investigated the influence of defects on structural, electronic and mechanical properties of single-walled carbon nanotubes (SWCNT), bundles of nanotubes and multi-walled carbon nanotubes (MWCNT). All our results were obtained with the first principles theory of total energy - Density Functional theory (DFT). We have investigated the structural prope
Publicado em: 2009