Interfacial Magnetic Anisotropy of Iron-Adsorbed Ferroelectric Perovskites: First-Principles and Machine Learning Study

Fuente: arXiv
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Main Authors: Jeong, Dameul, Kang, Seoung-Hun, Kwon, Young-Kyun
Format: Preprint
Published: 2023
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author Jeong, Dameul
Kang, Seoung-Hun
Kwon, Young-Kyun
author_facet Jeong, Dameul
Kang, Seoung-Hun
Kwon, Young-Kyun
contents The advancement of spin-based devices as a replacement for CMOS technology demands lower spin-switching energy in ferromagnetic (FM) materials. Ferroelectric (FE) materials offer a promising avenue for influencing FM properties, yet the mechanisms driving this interplay remain inadequately understood. In this study, we investigate iron-adsorbed FE ABO$_3$ perovskites using a combination of first-principles calculations and machine learning. Our findings reveal a universal correlation between the magnetic anisotropy energy (MAE) of iron and the induced magnetic dipole moments within the BO$_2$ layer and basal oxygen atoms of ABO$_3$ at the FE/FM interface. By identifying key material descriptors and achieving high predictive accuracy, this research provides a robust framework for selecting and optimizing ABO$_3$ substrates for energy-efficient spintronic devices. These insights contribute to the rational design of novel low-power spin-based technologies.
format Preprint
id arxiv_https___arxiv_org_abs_2306_07953
institution arXiv
publishDate 2023
record_format arxiv
spellingShingle Interfacial Magnetic Anisotropy of Iron-Adsorbed Ferroelectric Perovskites: First-Principles and Machine Learning Study
Jeong, Dameul
Kang, Seoung-Hun
Kwon, Young-Kyun
Materials Science
Mesoscale and Nanoscale Physics
The advancement of spin-based devices as a replacement for CMOS technology demands lower spin-switching energy in ferromagnetic (FM) materials. Ferroelectric (FE) materials offer a promising avenue for influencing FM properties, yet the mechanisms driving this interplay remain inadequately understood. In this study, we investigate iron-adsorbed FE ABO$_3$ perovskites using a combination of first-principles calculations and machine learning. Our findings reveal a universal correlation between the magnetic anisotropy energy (MAE) of iron and the induced magnetic dipole moments within the BO$_2$ layer and basal oxygen atoms of ABO$_3$ at the FE/FM interface. By identifying key material descriptors and achieving high predictive accuracy, this research provides a robust framework for selecting and optimizing ABO$_3$ substrates for energy-efficient spintronic devices. These insights contribute to the rational design of novel low-power spin-based technologies.
title Interfacial Magnetic Anisotropy of Iron-Adsorbed Ferroelectric Perovskites: First-Principles and Machine Learning Study
topic Materials Science
Mesoscale and Nanoscale Physics
url https://arxiv.org/abs/2306.07953