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The advancement of machine learning technologies has revolutionized the search and optimization of material properties. These algorithms often rely on theoretical calculations, such as density functional theory (DFT), for data inputs and…

材料科学 · 物理学 2024-11-06 Christopher Broyles , William Charles , Sheng Ran

Magnetic materials have been applied in a large variety of technologies, from data storage to quantum devices. The development of 2D materials has opened new arenas for magnetic compounds, even when classical theories discourage their…

材料科学 · 物理学 2022-02-11 Carlos Mera Acosta , Elton Ogoshi , Jose Antonio Souza , Gustavo M. Dalpian

Magnetic materials have a plethora of applications ranging from informatics to energy harvesting and conversion. However, such functionalities are limited by the magnetic ordering temperature. In this work, we performed machine learning on…

材料科学 · 物理学 2021-10-06 T. Long , N. M. Fortunato , Yixuan Zhang , O. Gutfleisch , H. Zhang

Accurately predicting magnetic behavior across diverse materials systems remains a longstanding challenge due to the complex interplay of structural and electronic factors and is pivotal for the accelerated discovery and design of…

材料科学 · 物理学 2025-07-03 Apoorv Verma , Junaid Jami , Amrita Bhattacharya

The identification and classification of different magnetic states are essential for understanding the complex behavior of magnetic systems. Traditional approaches that rely on handcrafted features or manual inspection often fall short,…

材料科学 · 物理学 2026-05-22 Amal Aldarawsheh , Ahmed Alia , Stefan Blügel

We use a machine learning approach to identify the importance of microstructure characteristics in causing magnetization reversal in ideally structured large-grained Nd$_2$Fe$_{14}$B permanent magnets. The embedded Stoner-Wohlfarth method…

The search of unconventional magnetic and nonmagnetic states is a major topic in the study of frustrated magnetism. Canonical examples of those states include various spin liquids and spin nematics. However, discerning their existence and…

统计力学 · 物理学 2019-02-20 Jonas Greitemann , Ke Liu , Lode Pollet

The reliable identification of magnetic ground states remains a major challenge in high-throughput materials databases, where density functional theory (DFT) workflows often converge to ferromagnetic (FM) solutions. Here, we partially…

材料科学 · 物理学 2026-03-24 Ahmed E. Fahmy

Magnetism has witnessed remarkable progress in recent decades, largely driven by its potential for next-generation storage devices. However, the classification of magnetic orders, even for fundamental concepts such as ferromagnetism and…

材料科学 · 物理学 2026-04-24 Yuntian Liu , Xiaobing Chen , Yutong Yu , Jesús Etxebarria , J. Manuel Perez-Mato , Qihang Liu

In this work, we employ a machine-learning-assisted high-throughput density functional theory framework to systematically investigate the stability, electronic structure, and magnetic ground states of 234 M$_4$X$_3$T$_x$ MXenes. The machine…

材料科学 · 物理学 2026-03-05 Sakshi Goel , Arti Kashyap

Ground state and low-energy excitations of the quasi-one-dimensional antiferromagnet CuSe$_2$O$_5$ were experimentally studied using bulk magnetization, neutron diffraction, muon spin relaxation and antiferromagnetic resonance measurements.…

An unconventional magnet may be mapped onto a simple ferromagnet by the existence of a high-symmetry point. Knowledge of conventional ferromagnetic systems may then be carried over to provide insight into more complex orders. Here we…

计算物理 · 物理学 2021-07-28 Nihal Rao , Ke Liu , Lode Pollet

Hexagonal MnTe emerges as a critical component in designing magnetic quantum heterostructures, calling for a detailed study. After finding a suitable combination of exchange-correlation functional and corrections, our study within {\em ab…

材料科学 · 物理学 2024-01-30 Suman Rooj , Jayita Chakraborty , Nirmal Ganguli

We analyze the itinerant model for antiferromagnetism, which was developed previously by Plischke, Mattis, Brouers and Mizia. In this model we include both; single-site and two-site electron correlations. Including additionally band…

强关联电子 · 物理学 2016-08-16 J. Mizia , G. Górski , K. Kucab

In the presence of strong electronic spin correlations, the hyperfine interaction imparts long-range coupling between nuclear spins. Efficient protocols for the extraction of such complex information about electron correlations via magnetic…

无序系统与神经网络 · 物理学 2023-05-10 Anantha Rao , Stephen Carr , Charles Snider , D. E. Feldman , Chandrasekhar Ramanathan , V. F. Mitrović

Actinide and lanthanide-based materials display exotic properties that originate from the presence of itinerant or localized f-electrons and include unconventional superconductivity and magnetism, hidden order; and heavy fermion behavior.…

材料科学 · 物理学 2021-02-26 Ayana Ghosh , Filip Ronning , Serge Nakhmanson , Jian-Xin Zhu

We demonstrate identification of position, material, orientation and shape of objects imaged by an $^{85}$Rb atomic magnetometer performing electromagnetic induction imaging supported by machine learning. Machine learning maximizes the…

原子物理 · 物理学 2018-01-24 Cameron Deans , Lewis D. Griffin , Luca Marmugi , Ferruccio Renzoni

Machine-learning techniques have proved successful in identifying ordered phases of matter. However, it remains an open question how far they can contribute to the understanding of phases without broken symmetry, such as spin liquids. Here…

强关联电子 · 物理学 2019-11-19 Jonas Greitemann , Ke Liu , Ludovic D. C. Jaubert , Han Yan , Nic Shannon , Lode Pollet

We present a perspective on the status of antiferromagnetism in two-dimensional (2D) materials. Various types of spin-compensated orders are discussed and include non-collinear order, spin spirals and altermagnetism. Spin-orbit effects…

材料科学 · 物理学 2024-08-09 Thomas Olsen

We report the connection between the stacking order and magnetic properties of bilayer CrI$_3$ using first-principles calculations. We show that the stacking order defines the magnetic ground state. By changing the interlayer stacking order…

材料科学 · 物理学 2018-11-19 Nikhil Sivadas , Satoshi Okamoto , Xiaodong Xu , Craig. J. Fennie , Di Xiao
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