Abstract

The structural stability, spin-polarized electronic and transport properties of edge-hydrogenated zigzag boron nitride nanoribbons (ZBNNRs) are investigated using density functional theory (DFT) combined with a non-equilibrium Green’s function (NEGF) approach. The considered structures are observed to be energetically stable in the magnetic ground state. The calculated spin-dependent transport properties indicate that a selective-edge hydrogenated ZBNNR device shows bipolar spin filter characteristics. Interestingly, high spin giant magnetoresistance (GMR) and a rectification ratio (RR) are observed of the order of 10 <sup xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">15</sup> and 10 <sup xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink">10</sup> , respectively. The observed GMR and rectification behavior in edge-hydrogenated ZBNNRs have potential applications for designing future spintronic nanodevices.

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