论文标题

当前诱导的MN2AU从第一原理转换

Current induced switching in Mn2Au from first principles

论文作者

Selzer, Severin, Salemi, Leandro, Deák, András, Simon, Eszter, Szunyogh, László, Oppeneer, Peter M., Nowak, Ulrich

论文摘要

众所周知,可以用电气切换某些抗铁磁铁,但是Néel-Spin-orbit轨道的相互作用和热激活只有很少的了解。结合了从头算计算和原子自旋动力学模拟,我们开发了一个多尺度模型来研究MN2AU中当前诱导的切换。我们从第一原理计算出由Rashba-Edelstein效应引起的电诱导磁矩的强度和方向,并在原子旋转动力学模拟中考虑了这些效果。我们的模拟揭示了开关路径以及切换的时间尺度。然而,诱导力矩的大小不足以导致完全确定性的切换。取而代之的是,我们发现需要一定程度的热激活来帮助克服相关的能屏障。

It is well established that it is possible to switch certain antiferromagnets electrically, yet the interplay of Néel-spin-orbit torques and thermal activation is only poorly understood. Combining ab initio calculations and atomistic spin dynamics simulations we develop a multiscale model to study the current induced switching in Mn2Au. We compute from first principles the strength and direction of the electrically induced magnetic moments, caused by the Rashba--Edelstein effect, and take these into account in atomistic spin dynamics simulations. Our simulations reveal the switching paths as well as the time scales for switching. The size of the induced moments, however, turns out to be insufficient to lead to fully deterministic switching. Instead, we find that a certain degree of thermal activation is required to help overcoming the relevant energy barrier.

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