Location-dependent Stone-Wales defect in C/BN heteronanotube: A density functional theory approach
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DOI: 10.1016/j.physe.2019.04.023
Abstract: Abstract Ab initio pseudopotential density functional calculations of location-dependent Stone-Wales (SW) defect are performed to investigate the electronic and optical characteristics of (10,0) zigzag-edged hybrid Carbone/Boron-Nitride (C/BN) heteronanotubes which recently have been proposed to exhibit… read more here.
Keywords: dependent stone; location dependent; stone wales; density functional ... See more keywords