Article ID Journal Published Year Pages File Type
7961247 Computational Materials Science 2014 6 Pages PDF
Abstract
Adsorption of toxic carbon monoxide molecule (CO) on super cell Al/N-substituted (10,0) single walled carbon nanotubes with different sites is investigated by using density functional theory.
Keywords
Related Topics
Physical Sciences and Engineering Engineering Computational Mechanics
Preview
Density functional study of Al/N co-doped (10,0) zigzag single-walled carbon nanotubes as CO sensor
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