Tunable electronic and magnetic properties of antimonene system via Fe doping and defect complex: A first-principles perspective
Sign Up to like & getrecommendations! Published in 2018 at "Applied Surface Science"
DOI: 10.1016/j.apsusc.2018.04.135
Abstract: Abstract We investigate the electronic and magnetic properties of Fe-doped (FeSb) and defect complex (FeSb + VSb) tuned antimonene systems. Our calculations showed that the method of generalized gradient approximation with on-site Coulomb repulsion (GGA+U) obtained a… read more here.
Keywords: system; defect complex; magnetic properties; electronic magnetic ... See more keywords
Transition Metal-Doped Tin Monoxide Monolayer: A First-Principles Study
Sign Up to like & getrecommendations! Published in 2018 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.7b12282
Abstract: Using first principles calculations, the structural and electronic properties of monolayer SnO doped with 3d transition metals from V to Co were investigated. The results indicate that the substitutional doping is preferred under oxygen rich… read more here.
Keywords: transition metal; transition; defect complex; tin ... See more keywords