Large spin-filtering effect in Ti-doped defective zigzag graphene nanoribbon.


Through first-principles calculations using the nonequilibrium Green's function formalism together with density functional theory, we study the conductance of double-vacancy zigzag graphene nanoribbons doped with four transition metal atoms Ti, V, Cr and Fe. We show that Ti doping induces large spin-filtering with an efficiency in excess of 90% for bias… (More)
DOI: 10.1039/c6cp01601d


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