Sensitive dependence of pairing symmetry on Ni-eg crystal field splitting in the nickelate superconductor La3Ni2O7

被引:2
作者
Xia, Chengliang [1 ]
Liu, Hongquan [1 ,2 ]
Zhou, Shengjie [1 ]
Chen, Hanghui [1 ,3 ]
机构
[1] NYU Shanghai, NYU ECNU Inst Phys, Shanghai, Peoples R China
[2] Brown Univ, Dept Phys, Providence, RI USA
[3] NYU, DEPT PHYS, New York, NY 10012 USA
基金
中国国家自然科学基金;
关键词
TOTAL-ENERGY CALCULATIONS; ELECTRON CORRELATION; TRANSITION;
D O I
10.1038/s41467-025-56206-0
中图分类号
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号
07 ; 0710 ; 09 ;
摘要
The discovery of high-temperature superconductivity in La3Ni2O7 under pressure has drawn great attention. However, consensus has not been reached on its pairing symmetry in theory. By combining density-functional-theory (DFT), maximally-localized-Wannier-function, and linearized gap equation with random-phase-approximation, we find that the pairing symmetry of La3Ni2O7 is dxy, if its DFT band structure is accurately reproduced by a downfolded bilayer two-orbital model. More importantly, we reveal that the pairing symmetry of La3Ni2O7 sensitively depends on the crystal field splitting between two Ni-eg orbitals. A slight increase in Ni-eg crystal field splitting alters the pairing symmetry from dxy to s +/-. Such a transition is associated with the change in inverse Fermi velocity and susceptibility, while the shape of Fermi surface remains almost unchanged. Our work highlights the sensitive dependence of pairing symmetry on low-energy electronic structures in multi-orbital superconductors, which calls for care in the downfolding procedure when one calculates their pairing symmetry.
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页数:11
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