Strain energy calculations of hexagonal boron nanotubes: An ab-initio approach

An ab initio calculations have been carried out for examining the curvature effect of small diameter hexagonal boron nanotubes. The considered conformations of boron nanotubes are namely armchair (3,3), zigzag (5,0) and chiral (4,2), and consist of 12, 20, and 56 atoms, respectively. The strain ener...

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Bibliographic Details
Main Authors: S.K. Jain, P. Srivastava
Format: Article
Language:English
Published: Institute for Condensed Matter Physics 2013-01-01
Series:Condensed Matter Physics
Subjects:
Online Access:http://dx.doi.org/10.5488/CMP.16.33802