Abstract
We report a large magnetoresistance observed in a Fe/MoS2/Fe tunnel junction, where iron electrodes are attached to the edges of MoS2 nanoribbon (i.e. the current is flowing in the plane of the MoS2 2D monolayer). Using non-equilibrium Green's functions in the framework of density functional approach, our calculations show a large magnetoresistance in Fe/MoS2/Fe junction, with the values up to 150%. The strong coupling between states of Mo atoms at the edge of the MoS2 monolayer and those at the Fe surface have a dramatic effect on the conductance property of the material as well as the MR of the Fe/MoS2/Fe tunnel junction. We conclude that the Fe electrodes polarize the spin states of MoS2 near the interface and efficiently inject carriers into MoS2. We find that the atomically-thin spacers are metallic due to a strong hybridization between the Fe and Mo states at the interface. MoS2 spacers of a larger width remain insulating. We also find that the magnetoresistance of thin MoS2 ribbons (three atomic layers wide) is negative and has a small value. Notably however, as the width of the MoS2 spacer increases, this value turns positive and increases in magnitude.
Original language | English (US) |
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Pages (from-to) | 15-22 |
Number of pages | 8 |
Journal | Computational Materials Science |
Volume | 124 |
DOIs | |
State | Published - Nov 1 2016 |
Keywords
- Fe/MoS/Fe
- Magnetoresistance
- Tunnel junction
ASJC Scopus subject areas
- Computer Science(all)
- Chemistry(all)
- Materials Science(all)
- Mechanics of Materials
- Physics and Astronomy(all)
- Computational Mathematics