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Main Authors: Yang, Aiqin, Tao, Xiangru, Quan, Yundi, Zhang, Peng
Format: Preprint
Published: 2024
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Online Access:https://arxiv.org/abs/2410.18405
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author Yang, Aiqin
Tao, Xiangru
Quan, Yundi
Zhang, Peng
author_facet Yang, Aiqin
Tao, Xiangru
Quan, Yundi
Zhang, Peng
contents A recent experiment by Shan {\it et al} [arXiv:2304.09011] found that rhenium trioxide ReO$_3$, a simple metal at the ambient pressure, becomes superconducting with a transition temperature as high as 17 K at 30 GPa. In this paper, we analyze the electron-phonon origin of superconductivity in rhombohedral ReO$_3$ in detail. In addition, we also conduct a high-throughout screening of isostructural transition-metal trioxides XO$_3$ in searching for potential pressure-induced superconductors. Totally twenty-eight XO$_3$ compounds have been studied, in which four candidates RuO$_3$, OsO$_3$, IrO$_3$ and PtO$_3$ are predicted superconducting with the transition temperatures of 26.4, 30.3, 0.9 and 2.8 K at 30 GPa, respectively. Both IrO$_3$ and PtO$_3$ stay superconducting even at the ambient pressure. In ReO$_3$, RuO$_3, $OsO$_3$ and IrO$_3$, the conduction electrons around the Fermi level are dominantly from the X-d and the O-2p orbitals, and their electron-phonon coupling originates from the lattice dynamics of both the heavier transition-metal-atom and the oxygen-atom. Inclusion of spin-orbital coupling would mildly suppress the transition temperatures of these transition-metal trioxide superconductors except RuO$_3$.
format Preprint
id arxiv_https___arxiv_org_abs_2410_18405
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Phonon-mediated superconductivity in transition-metal trioxides XO3 (X = Ru, Re, Os, Ir, Pt) under pressure
Yang, Aiqin
Tao, Xiangru
Quan, Yundi
Zhang, Peng
Superconductivity
A recent experiment by Shan {\it et al} [arXiv:2304.09011] found that rhenium trioxide ReO$_3$, a simple metal at the ambient pressure, becomes superconducting with a transition temperature as high as 17 K at 30 GPa. In this paper, we analyze the electron-phonon origin of superconductivity in rhombohedral ReO$_3$ in detail. In addition, we also conduct a high-throughout screening of isostructural transition-metal trioxides XO$_3$ in searching for potential pressure-induced superconductors. Totally twenty-eight XO$_3$ compounds have been studied, in which four candidates RuO$_3$, OsO$_3$, IrO$_3$ and PtO$_3$ are predicted superconducting with the transition temperatures of 26.4, 30.3, 0.9 and 2.8 K at 30 GPa, respectively. Both IrO$_3$ and PtO$_3$ stay superconducting even at the ambient pressure. In ReO$_3$, RuO$_3, $OsO$_3$ and IrO$_3$, the conduction electrons around the Fermi level are dominantly from the X-d and the O-2p orbitals, and their electron-phonon coupling originates from the lattice dynamics of both the heavier transition-metal-atom and the oxygen-atom. Inclusion of spin-orbital coupling would mildly suppress the transition temperatures of these transition-metal trioxide superconductors except RuO$_3$.
title Phonon-mediated superconductivity in transition-metal trioxides XO3 (X = Ru, Re, Os, Ir, Pt) under pressure
topic Superconductivity
url https://arxiv.org/abs/2410.18405