Article ID Journal Published Year Pages File Type
5381618 Chemical Physics Letters 2013 18 Pages PDF
Abstract

- The calculations were carried out through DFT without assuming any boundaries for the CNT.
- Two varietal configurations of (10,0) SWCNT have been investigated.
- Adsorption of thiophene onto the surface of (10,0) CNT, grants it a metallic property.
- The concentration and configuration of thiophene/CNT is effective on its electronic properties.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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