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arXiv 1503.08649cond-mat.mes-hall
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磷烯的范霍夫奇异性和铁磁不稳定性

Van Hove singularity and ferromagnetic instability in phosphorene

A. Ziletti, S. M. Huang, D. F. Coker, H. Lin

摘要:

使用Wannier函数为基础的插值技术,我们提出了令人信服的数值证据的鞍点范霍夫奇点的存在下,在$Γ$点附近的磷烯费米能量。我们发现,在接近的范霍夫奇异性的自旋磁化率提出了对数温度依赖典型的Liftshitz相变。此外,我们表明,铁磁转变的临界温度可以大大增加(高达0.05 K),如果应变沿锯齿形脊。虽然铁磁状态将是非常难以实验达到的,对数温度行为的自旋磁化率由于范霍夫奇点被发现持续在更高的温度(高达$\sim$ 97 K)。

英文摘要:

Using Wannier function-based interpolation techniques, we present compelling numerical evidence for the presence of a saddle-point van Hove singularity at the $Γ$ point near the phosphorene Fermi energy. We show that in proximity of the van Hove singularity the spin susceptibility presents the logarithmic temperature dependence typical of Liftshitz phase transitions. Furthermore, we demonstrate that the critical temperature for the ferromagnetic transition can be greatly increased (up to 0.05 K) if strain along the zigzag ridges is applied. Although the ferromagnetic state would be very difficult to experimentally reach, the logarithmic temperature behaviour of the spin susceptibility due to the van Hove singularity is found to persist at much higher temperatures (up to $\sim$97 K).

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