Spin transport through a junction entirely consisting of molecules from first principles
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DOI: 10.1063/1.5009744
Abstract: Using first-principles calculations based on density functional theory combined with the nonequilibrium Green's function formalism, we studied the spin transport through a single molecular junction which consists of a single 1,4-benzenedithiolate (BDT) molecule and two… read more here.
Keywords: spin transport; junction entirely; molecular junction; transport junction ... See more keywords