RKKY Interactions and Multipole Order in Ab initio Wannier Model of CeCoSi

Fuente: arXiv
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Autori principali: Yamada, Takemi, Yanagi, Yuki, Mitsumoto, Keisuke
Natura: Preprint
Pubblicazione: 2024
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author Yamada, Takemi
Yanagi, Yuki
Mitsumoto, Keisuke
author_facet Yamada, Takemi
Yanagi, Yuki
Mitsumoto, Keisuke
contents We calculate the RKKY interactions derived from ab initio calculations for the intermetallic compound CeCoSi exhibiting the hidden nonmagnetic order at $T_0$ and examine the instability towards possible multipole orders within the random phase approximation. All 36 multipole interactions up to rank 5 are investigated, and the maximum susceptibility exhibits an antiferro order with $\boldsymbol{q}=\boldsymbol{0}$ for nonmagnetic multipoles of monopole $I$ and hexadecapole $H_{0}$, yielding a charge imbalance of $f$ electrons at two Ce atoms in the unit cell. The obtained order can explain some experiments.
format Preprint
id arxiv_https___arxiv_org_abs_2403_08172
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle RKKY Interactions and Multipole Order in Ab initio Wannier Model of CeCoSi
Yamada, Takemi
Yanagi, Yuki
Mitsumoto, Keisuke
Strongly Correlated Electrons
We calculate the RKKY interactions derived from ab initio calculations for the intermetallic compound CeCoSi exhibiting the hidden nonmagnetic order at $T_0$ and examine the instability towards possible multipole orders within the random phase approximation. All 36 multipole interactions up to rank 5 are investigated, and the maximum susceptibility exhibits an antiferro order with $\boldsymbol{q}=\boldsymbol{0}$ for nonmagnetic multipoles of monopole $I$ and hexadecapole $H_{0}$, yielding a charge imbalance of $f$ electrons at two Ce atoms in the unit cell. The obtained order can explain some experiments.
title RKKY Interactions and Multipole Order in Ab initio Wannier Model of CeCoSi
topic Strongly Correlated Electrons
url https://arxiv.org/abs/2403.08172