手性晶格反铁磁体CoNb3S6的节面间隙和大拓扑能子效应

IF 15.7 1区 综合性期刊 Q1 MULTIDISCIPLINARY SCIENCES
Nguyen Duy Khanh, Susumu Minami, Moritz M. Hirschmann, Takuya Nomoto, Ming-Chun Jiang, Rinsuke Yamada, Niclas Heinsdorf, Daiki Yamaguchi, Yudai Hayashi, Yoshihiro Okamura, Hikaru Watanabe, Guang-Yu Guo, Youtarou Takahashi, Shinichiro Seki, Yasujiro Taguchi, Yoshinori Tokura, Ryotaro Arita, Max Hirschberger
{"title":"手性晶格反铁磁体CoNb3S6的节面间隙和大拓扑能子效应","authors":"Nguyen Duy Khanh, Susumu Minami, Moritz M. Hirschmann, Takuya Nomoto, Ming-Chun Jiang, Rinsuke Yamada, Niclas Heinsdorf, Daiki Yamaguchi, Yudai Hayashi, Yoshihiro Okamura, Hikaru Watanabe, Guang-Yu Guo, Youtarou Takahashi, Shinichiro Seki, Yasujiro Taguchi, Yoshinori Tokura, Ryotaro Arita, Max Hirschberger","doi":"10.1038/s41467-025-57320-9","DOIUrl":null,"url":null,"abstract":"<p>The electronic structure of compensated antiferromagnets (CAF) creates large functional responses, reminiscent of ferromagnets and suitable for data storage and readout, despite (nearly) net-zero spontaneous magnetization. Many experimental signatures of CAF - such as giant thermoelectric Nernst effects - should be enhanced when two or more electronic bands are nearly degenerate in vicinity of the Fermi energy. Here, we report a zero-field, thermoelectric Nernst effect &gt;1 <i>μ</i>V/K in the CAF CoNb<sub>3</sub>S<sub>6</sub> despite its tiny net magnetization ~2 milli − <i>μ</i><sub>B</sub>. As drivers of the functional Nernst and Hall effects, we identify near-degeneracies of electron bands at the upper and lower boundaries of the first Brillouin zone, which are vestiges of nodal planes enforced by a screw axis symmetry in the paramagnetic state. Hot spots of emergent, or fictitious, magnetic fields are formed at the slightly gapped nodal planes. Taking into account more than six hundred Wannier orbitals, our theoretical model reproduces the observed spontaneous Nernst effect, emphasizes the role of proximate spin-space group symmetries and nodal planes for the electronic structure of CAF, and demonstrates the promise of ab-initio search for functional responses in a wide class of materials with reconstructed unit cells (supercells) due to spin or charge order.</p>","PeriodicalId":19066,"journal":{"name":"Nature Communications","volume":"29 1","pages":""},"PeriodicalIF":15.7000,"publicationDate":"2025-03-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Gapped nodal planes and large topological Nernst effect in the chiral lattice antiferromagnet CoNb3S6\",\"authors\":\"Nguyen Duy Khanh, Susumu Minami, Moritz M. Hirschmann, Takuya Nomoto, Ming-Chun Jiang, Rinsuke Yamada, Niclas Heinsdorf, Daiki Yamaguchi, Yudai Hayashi, Yoshihiro Okamura, Hikaru Watanabe, Guang-Yu Guo, Youtarou Takahashi, Shinichiro Seki, Yasujiro Taguchi, Yoshinori Tokura, Ryotaro Arita, Max Hirschberger\",\"doi\":\"10.1038/s41467-025-57320-9\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p>The electronic structure of compensated antiferromagnets (CAF) creates large functional responses, reminiscent of ferromagnets and suitable for data storage and readout, despite (nearly) net-zero spontaneous magnetization. Many experimental signatures of CAF - such as giant thermoelectric Nernst effects - should be enhanced when two or more electronic bands are nearly degenerate in vicinity of the Fermi energy. Here, we report a zero-field, thermoelectric Nernst effect &gt;1 <i>μ</i>V/K in the CAF CoNb<sub>3</sub>S<sub>6</sub> despite its tiny net magnetization ~2 milli − <i>μ</i><sub>B</sub>. As drivers of the functional Nernst and Hall effects, we identify near-degeneracies of electron bands at the upper and lower boundaries of the first Brillouin zone, which are vestiges of nodal planes enforced by a screw axis symmetry in the paramagnetic state. Hot spots of emergent, or fictitious, magnetic fields are formed at the slightly gapped nodal planes. Taking into account more than six hundred Wannier orbitals, our theoretical model reproduces the observed spontaneous Nernst effect, emphasizes the role of proximate spin-space group symmetries and nodal planes for the electronic structure of CAF, and demonstrates the promise of ab-initio search for functional responses in a wide class of materials with reconstructed unit cells (supercells) due to spin or charge order.</p>\",\"PeriodicalId\":19066,\"journal\":{\"name\":\"Nature Communications\",\"volume\":\"29 1\",\"pages\":\"\"},\"PeriodicalIF\":15.7000,\"publicationDate\":\"2025-03-26\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Nature Communications\",\"FirstCategoryId\":\"103\",\"ListUrlMain\":\"https://doi.org/10.1038/s41467-025-57320-9\",\"RegionNum\":1,\"RegionCategory\":\"综合性期刊\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"MULTIDISCIPLINARY SCIENCES\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Nature Communications","FirstCategoryId":"103","ListUrlMain":"https://doi.org/10.1038/s41467-025-57320-9","RegionNum":1,"RegionCategory":"综合性期刊","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"MULTIDISCIPLINARY SCIENCES","Score":null,"Total":0}
引用次数: 0

摘要

补偿反铁磁体(CAF)的电子结构产生了大的功能响应,让人想起铁磁体,适用于数据存储和读出,尽管(几乎)净零自发磁化。当两个或多个电子带在费米能量附近几乎简并时,CAF的许多实验特征——比如巨大的热电能效应——应该得到增强。在这里,我们报道了CAF CoNb3S6的零场热电能效应>;1 μV/K,尽管它的净磁化强度很小~2 μ i−μB。作为功能能斯特和霍尔效应的驱动因素,我们在第一布里温区上下边界发现了电子带的近简并,这是顺磁状态下螺旋轴对称所强制的节面痕迹。突现或虚构的磁场热点在微间隙的节点面上形成。考虑到超过600个万尼尔轨道,我们的理论模型再现了观察到的自发能斯特效应,强调了CAF电子结构中近似自旋-空间群对称性和节点面的作用,并展示了在具有自旋或电荷顺序重构的单位细胞(超细胞)的广泛材料中从头算搜索功能响应的前景。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Gapped nodal planes and large topological Nernst effect in the chiral lattice antiferromagnet CoNb3S6

Gapped nodal planes and large topological Nernst effect in the chiral lattice antiferromagnet CoNb3S6

The electronic structure of compensated antiferromagnets (CAF) creates large functional responses, reminiscent of ferromagnets and suitable for data storage and readout, despite (nearly) net-zero spontaneous magnetization. Many experimental signatures of CAF - such as giant thermoelectric Nernst effects - should be enhanced when two or more electronic bands are nearly degenerate in vicinity of the Fermi energy. Here, we report a zero-field, thermoelectric Nernst effect >1 μV/K in the CAF CoNb3S6 despite its tiny net magnetization ~2 milli − μB. As drivers of the functional Nernst and Hall effects, we identify near-degeneracies of electron bands at the upper and lower boundaries of the first Brillouin zone, which are vestiges of nodal planes enforced by a screw axis symmetry in the paramagnetic state. Hot spots of emergent, or fictitious, magnetic fields are formed at the slightly gapped nodal planes. Taking into account more than six hundred Wannier orbitals, our theoretical model reproduces the observed spontaneous Nernst effect, emphasizes the role of proximate spin-space group symmetries and nodal planes for the electronic structure of CAF, and demonstrates the promise of ab-initio search for functional responses in a wide class of materials with reconstructed unit cells (supercells) due to spin or charge order.

求助全文
通过发布文献求助,成功后即可免费获取论文全文。 去求助
来源期刊
Nature Communications
Nature Communications Biological Science Disciplines-
CiteScore
24.90
自引率
2.40%
发文量
6928
审稿时长
3.7 months
期刊介绍: Nature Communications, an open-access journal, publishes high-quality research spanning all areas of the natural sciences. Papers featured in the journal showcase significant advances relevant to specialists in each respective field. With a 2-year impact factor of 16.6 (2022) and a median time of 8 days from submission to the first editorial decision, Nature Communications is committed to rapid dissemination of research findings. As a multidisciplinary journal, it welcomes contributions from biological, health, physical, chemical, Earth, social, mathematical, applied, and engineering sciences, aiming to highlight important breakthroughs within each domain.
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
确定
请完成安全验证×
copy
已复制链接
快去分享给好友吧!
我知道了
右上角分享
点击右上角分享
0
联系我们:info@booksci.cn Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。 Copyright © 2023 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号:604180095
Book学术官方微信