1. First principles investigation of the spin transport properties in graphene-porphine-graphene nanojunctions.
- Author
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Liu, Yi and Zhong, Huicai
- Subjects
- *
GREEN'S functions , *TUNNEL magnetoresistance , *DENSITY functional theory , *DENSITY of states - Abstract
The spin-dependent transport properties of a porphine molecule linking with two zigzag-edged graphene nanoribbon (ZGNR) electrodes have been investigated by using the density of functional theory (DFT) combined with the non-equilibrium Green's function (NEGF) method. The device shows clearly negative differential resistance (NDR), large tunnelling magnetoresistance (TMR) of 103 magnitude and nearly 100% perfect spin filter efficiency (SFE) properties, respectively. What's more, the projected density of states (PDOS), molecular projected self-consistent Hamiltonian (MPSH) eigenvalues and transmission eigenstates were carried out to discuss the transport properties of the ZGNR/Porphine/ZGNR nanojunction. These results suggest that the ZGNR/Porphine/ZGNR device is a promising candidate for multi-functional spintronic devices. [ABSTRACT FROM AUTHOR]
- Published
- 2020
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