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arXiv 2405.02494cond-mat.mtrl-sci
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化学无序对FeCo合金Gilbert阻尼的影响

Chemical disorder effects on the Gilbert damping of FeCo alloys

Zhiwei Lu, I. P. Miranda, Simon Streib, Qichen Xu, Rajgowrav Cheenikundil, Manuel Pereiro, Erik Sjöqvist, Olle Eriksson, Anders Bergman, Danny Thonig, Anna Delin

AI总结:

本文基于密度泛函理论计算,研究FeCo合金中局域化学环境对Gilbert阻尼的影响,发现最近邻Co含量和Co-Co距离可显著增大阻尼,并提出通过局域化学工程调控阻尼以服务自旋电子学应用。

摘要:

基于密度泛函理论的计算,研究了局域化学环境对二元合金Fe$_{100-x}$Co$_{x}$中Gilbert阻尼的影响。通过改变合金成分x以及Fe/Co原子位置,我们发现合金的有效阻尼对最近邻环境高度敏感,尤其是对Co的含量以及最近邻位置上Co-Co原子之间的平均距离。两者都会导致有效Gilbert阻尼显著局域增大(最高可达一个数量级),这主要来源于费米能处态密度的变化。从全局视角来看(即对真实材料做构型平均),这些阻尼差异会被统计平均所掩盖。当进行低温显式原子尺度动力学模拟时,观察到短程无序对局域动力学的影响也会改变整体弛豫速率。我们的结果说明了通过局域化学手段调控Gilbert阻尼的可能性,这可能促进研究调控材料的新方法,以面向自旋电子学应用。

英文摘要:

The impact of the local chemical environment on the Gilbert damping in the binary alloy Fe$_{100-x}$Co$_{x}$ is investigated, using computations based on density functional theory. By varying the alloy composition x as well as Fe/Co atom positions we reveal that the effective damping of the alloy is highly sensitive to the nearest neighbor environment, especially to the amount of Co and the average distance between Co-Co atoms at nearest neighbor sites. Both lead to a significant local increase (up to an order of magnitude) of the effective Gilbert damping, originating mainly from variations of the density of states at the Fermi energy. In a global perspective (i.e., making a configuration average for a real material), those differences in damping are masked by statistical averages. When low-temperature explicit atomistic dynamics simulations are performed, the impact of short-range disorder on local dynamics is observed to also alter the overall relaxation rate. Our results illustrate the possibility of local chemical engineering of the Gilbert damping, which may stimulate the study of new ways to tune and control materials aiming for spintronics applications.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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