Jiaqi Zhou

Origin of interfacial perpendicular magnetic anisotropy in MgO/CoFe/metallic capping layer structures

Spin-transfer-torque magnetic random access memory (STT-MRAM) attracts extensive attentions due to its non-volatility, high density and low power consumption. The core device in STT-MRAM is CoFeB/MgO-based magnetic tunnel junction (MTJ), which possesses a high tunnel magnetoresistance ratio as well as a large value of perpendicular magnetic anisotropy (PMA). It has been experimentally proven that a capping layer coating on CoFeB layer is essential to obtain a strong PMA. However, the physical mechanism of such effect remains unclear. In this paper, we investigate the origin of the PMA in MgO/CoFe/metallic capping layer structures by using a first-principles computation scheme. The trend of PMA variation with different capping materials agrees well with experimental results. We find that interfacial PMA in the three-layer structures comes from both the MgO/CoFe and CoFe/capping layer interfaces, which can be analyzed separately. Furthermore, the PMAs in the CoFe/capping layer interfaces are analyzed through resolving the magnetic anisotropy energy by layer and orbital. The variation of PMA with different capping materials is attributed to the different hybridizations of both d and p orbitals via spin-orbit coupling. This work can significantly benefit the research and development of nanoscale STT-MRAM.

Giant interfacial perpendicular magnetic anisotropy in MgO/CoFe/capping layer structures

Magnetic tunnel junction (MTJ) based on CoFeB/MgO/CoFeB structures is of great interest due to its application in the spin-transfer-torque magnetic random access memory (STT-MRAM). Large interfacial perpendicular magnetic anisotropy (PMA) is required to achieve high thermal stability. Here we use first-principles calculations to investigate the magnetic anisotropy energy (MAE) of MgO/CoFe/capping layer structures, where the capping materials include 5d metals Hf, Ta, Re, Os, Ir, Pt, Au and 6p metals Tl, Pb, Bi. We demonstrate that it is feasible to enhance PMA by using proper capping materials. Relatively large PMA is found in the structures with capping materials of Hf, Ta, Os, Ir and Pb. More importantly, the MgO/CoFe/Bi structure gives rise to giant PMA (6.09 mJ/m2), which is about three times larger than that of the MgO/CoFe/Ta structure. The origin of the MAE is elucidated by examining the contributions to MAE from each atomic layer and orbital. These findings provide a comprehensive understanding of the PMA and point towards the possibility to achieve advanced-node STT-MRAM with high thermal stability.

Large influence of capping layers on tunnel magnetoresistance in magnetic tunnel junctions

It has been reported in experiments that capping layers, which enhance the perpendicular magnetic anisotropy (PMA) of magnetic tunnel junctions (MTJs), induce a great impact on the tunnel magnetoresistance (TMR). To explore the essential influence caused by the capping layers, we carry out ab initio calculations on TMR in the X(001)|CoFe(001)|MgO(001)|CoFe(001)|X(001) MTJ, where X represents the capping layer material, which can be tungsten, tantalum, or hafnium. We report TMR in different MTJs and demonstrate that tungsten is an ideal candidate for a giant TMR ratio. The transmission spectrum in Brillouin zone is presented. It can be seen that in the parallel condition of MTJ, sharp transmission peaks appear in the minority-spin channel. This phenomenon is attributed to the resonant tunnel transmission effect, and we explained it by the layer-resolved density of states. In order to explore transport properties in MTJs, the density of scattering states was studied from the point of band symmetry. It has b...

Silicene spintronics: Fe(111)/silicene system for efficient spin injection

Silicene is an emerging 2D material with advantages of high carrier mobility, compatibility with the silicon-based semiconductor industry, and the tunable gap by a vertical electrical field due to the buckling structure. In this work, we report a first-principles investigation on the spin injection system, which consists of a Fe(111)/silicene stack as the spin injector and pure silicene as the spin channel. An extremely high spin injection efficiency (SIE) close to 100% is achieved. The partial density of states of Fe layers in the Fe(111)/silicene stack shows that spin-down states dominate above the Fermi level, resulting in a negligible spin-up current and high SIE. The transmission spectra have been investigated to analyze the spin-resolved properties. The spin injection system based on silicene is promising for the efficient silicon-based spintronics devices such as switching transistors.

High Tunnel Magnetoresistance in Mo/CoFe/MgO Magnetic Tunnel Junction: A First-Principles Study

The tunnel magnetoresistance (TMR) ratio in a magnetic tunnel junction (MTJ) is influenced by heavy metal capping layer due to the interfacial effect. We report a systematic first-principles study on MTJ based on CoFe/MgO with capping layer, demonstrate that TMR ratios are sensitive to capping layer material, and show that TMR in Mo-capped MTJ is three times as high as that in Ta-capped MTJ. Besides, TMR in Mo-capped MTJ remains high at finite voltage bias. By analyzing the transmission spectrum and density of scattering states, we found that coherent transmission of

Current-induced magnetization switching in atom-thick tungsten engineered perpendicular magnetic tunnel junctions with large tunnel magnetoresistance

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Tunneling magnetoresistance enhancement of magnetic tunnel junction through heavy metal layer symmetry

state dominates the majority-spin conductance in Mo-capped MTJ, while the resonant tunneling contributes significantly in Ta-capped MTJ. The evolution of TMR for varying MgO and CoFe thickness in Mo-capped MTJ is presented. TMR oscillates as a function of CoFe thickness because of the confined wave function in ferromagnetic layer, while TMR rises with MgO thickness increasing due to the enhanced filtering effect of MgO. This work clarifies the physical mechanism on high TMR in Mo-capped MTJ, which is promising to benefit the design of spintronics device.