Altermagnetism and weak magnetism in the insulating distorted perovskite antiferromagnet <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"> <mml:msub> <mml:mi>NaOsO</mml:mi> <mml:mn>3</mml:mn> </mml:msub> </mml:math>

The ${\mathrm{GdFeO}}_{3}$-type perovskite antiferromagnet ${\mathrm{NaOsO}}_{3}$, calculated here to be altermagnetic for all three typical collinear antiferromagnetic orders, was suggested early on to be a Slater-type insulator, due in large part to its continuous metal-insulator transition and its small energy gap. Below the N\'eel temperature, the gap opens along with ``weak magnetism'', accompanied by a sharp change in the magnetic susceptibility and resistivity. Without explicit correlation in the band structure calculation, and neglecting spin-orbit coupling (SOC), already a gap opens. Inclusion of a modest on-site Coulomb repulsion ($U\ensuremath{\sim}1$ eV) is sufficient to eliminate a SOC-induced small band overlap, opening a gap similar to the experimentally observed gap of around 100 meV. Combined evidence supports the viewpoint that ${\mathrm{NaOsO}}_{3}$ lies in an unusual crossover region between Slater and Mott insulator. The unreported altermagnetism in ${\mathrm{NaOsO}}_{3}$ is demonstrated and its consequences are considered. The origin of the very weak magnetism has been investigated using a combination of ab initio calculations and symmetry analysis of the magnetic space group, confirming the origin lying in the Dzyaloshinskii-Moriya SOC buttressed by altermagnetic order. After determining the easy axis, our calculation leads to an Os spin canting angle of about ${3}^{\ensuremath{\circ}}$, accounting for the observed weak magnetism and sharp change in the susceptibility. The altermagnetism spin-split bands (up to $\ensuremath{\sim}100$ meV) are accompanied by a chiral-split magnon spectrum in both acoustic and optical modes in the THz range, and lead to significant anomalous Hall conductivity upon hole doping.

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Publication Details

Journal
Physical Review Materials
Published
2025-12-08
DOI
https://doi.org/10.1103/ljrc-jcb4
Primary Topic
Advanced Condensed Matter Physics
Type
article
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article

Altermagnetism and weak magnetism in the insulating distorted perovskite antiferromagnet <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"> <mml:msub> <mml:mi>NaOsO</mml:mi> <mml:mn>3</mml:mn> </mml:msub> </mml:math>

Warren E. Pickett, Kwan-Woo Lee, Kyo‐Hoon Ahn, Myung‐Chul Jung et al.
Physical Review Materials
Advanced Condensed Matter Physics
article

Altermagnetism and weak magnetism in the insulating distorted perovskite antiferromagnet <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"> <mml:msub> <mml:mi>NaOsO</mml:mi> <mml:mn>3</mml:mn> </mml:msub> </mml:math>

Warren E. Pickett, Kwan-Woo Lee, Kyo‐Hoon Ahn, Myung‐Chul Jung, Heon‐Jin Choi
article en

Abstract

The ${\mathrm{GdFeO}}_{3}$-type perovskite antiferromagnet ${\mathrm{NaOsO}}_{3}$, calculated here to be altermagnetic for all three typical collinear antiferromagnetic orders, was suggested early on to be a Slater-type insulator, due in large part to its continuous metal-insulator transition and its small energy gap. Below the N\'eel temperature, the gap opens along with ``weak magnetism'', accompanied by a sharp change in the magnetic susceptibility and resistivity. Without explicit correlation in the band structure calculation, and neglecting spin-orbit coupling (SOC), already a gap opens. Inclusion of a modest on-site Coulomb repulsion ($U\ensuremath{\sim}1$ eV) is sufficient to eliminate a SOC-induced small band overlap, opening a gap similar to the experimentally observed gap of around 100 meV. Combined evidence supports the viewpoint that ${\mathrm{NaOsO}}_{3}$ lies in an unusual crossover region between Slater and Mott insulator. The unreported altermagnetism in ${\mathrm{NaOsO}}_{3}$ is demonstrated and its consequences are considered. The origin of the very weak magnetism has been investigated using a combination of ab initio calculations and symmetry analysis of the magnetic space group, confirming the origin lying in the Dzyaloshinskii-Moriya SOC buttressed by altermagnetic order. After determining the easy axis, our calculation leads to an Os spin canting angle of about ${3}^{\ensuremath{\circ}}$, accounting for the observed weak magnetism and sharp change in the susceptibility. The altermagnetism spin-split bands (up to $\ensuremath{\sim}100$ meV) are accompanied by a chiral-split magnon spectrum in both acoustic and optical modes in the THz range, and lead to significant anomalous Hall conductivity upon hole doping.

Physical Review MaterialsVol. 9(12)
Korea University (KR), Czech Academy of Sciences (CZ), Sejong University (KR), Seoul Semiconductor (South Korea) (KR), University of California, Davis (US)
Openalex Percentile: Top 75%
Advanced Condensed Matter Physics
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