▎ 摘 要
At B3LYP level of theory, we predict that the half-metallicity in zigzag edge graphene nanoribbon (ZGNR) can be realized when an external electric field is applied across the ribbon. The critical electric field decreases with the increase of the ribbon width to induce the half-metallicity. Both the spin polarization and half-metallicity are removed when the edge state electrons fully transferred from one side to the other under very strong electric field. The electric field range under which ZGNR remains half-metallic increases with the ribbon width. Our study demonstrates a rich field-induced spin polarization behavior, which may lead to some important applications in spinstronics. (C) 2007 American Institute of Physics.