Room-temperature ferromagnetism in two-dimensional Mn2B
VACUUM(2024)
摘要
Two-dimensional magnets with long-range magnetic order are desired for their potential applications in spintronics. Here, we propose an intrinsic two-dimensional ferromagnetism in Mn2B MBene. It is shown that Mn2B is in a metallic and ferromagnetic ground state based on first-principles calculations. The magnetic anisotropy is derived mainly from both the spin-orbit coupling (SOC) and dipole-dipole interactions. Normally, the dipole-dipole interaction is significantly smaller and is often overshadowed by the SOC. Nevertheless, the dipole -dipole interaction has superseded the SOC interaction, assuming a pivotal role in shaping Mn2B's magnetic anisotropy. Eventually, the net magnetic anisotropy energy of Mn2B is -80.7 mu eV per unit cell (-1.69 x 10(-4) J/m(2)) with in-plane magnetization, due to the larger magnetic shape anisotropy. Moreover, the critical tempera-ture is estimated to be 548 K based on the Monte Carlo simulation of Heisenberg model, which is much higher than room temperature. Our findings indicate that Mn2B is potentially useful in spintronic devices.
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关键词
Two-dimensional ferromagnetism,First-principles calculation,Magnetic anisotropy,Dipole-dipole interaction,Critical temperature
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