Article ID Journal Published Year Pages File Type
5394422 Computational and Theoretical Chemistry 2012 5 Pages PDF
Abstract
► Doping of four and six B, Al, N, and P on C28 leads to Td and C2 symmetry heterofullerenes.► Aromatic C24N4 and C22N6 are the most stable heterofullerenes among all. ► Electronic conductivity is increased through B and Al doping.
Keywords
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
A DFT study on the structural and electronic properties of Td and C2 symmetry C24X4 and C22X6 heterofullerenes (X = B, Al, N, and P)
Authors
, , , ,