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中国物理学会期刊

铜基二轨道哈伯德模型中自旋条纹序与超导电性相互关系的量子蒙特卡罗研究

CSTR: 32037.14.aps.75.20251362

Quantum Monte Carlo study of interplay between spin stripe order and superconductivity in copper based two-orbital Hubbard model

CSTR: 32037.14.aps.75.20251362
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  • 为澄清铜氧化物高温超导材料具有不同超导转变温度的原因以及自旋条纹序和超导电性之间的关系, 基于铜基二轨道哈伯德模型, 采用大尺度无偏差的约束路径量子蒙特卡罗方法研究了\rmCu的\rmd_3z^2-r^2轨道对\rmLSCO和\rmHBCO两类典型的铜基超导体中的超导电性和自旋条纹序的影响. 首先, 研究不同类型的铜基超导材料的轨道能级差的差异. 数值结果显示, 相比于\rmLSCO超导材料, \rmHBCO超导材料中的d波超导电子配对对称性的配对关联函数和有效配对关联函数的强度表现出更为显著的优势, 表明\rmHBCO超导材料的超导转变温度高于\rmLSCO超导材料的超导转变温度的原因与\rmCu的\rmd_3z^2-r^2轨道的作用有关. 其次, 考察\rmLSCO和\rmHBCO两类超导材料中自旋条纹序的形成情况. 数值模拟结果显示, \rmLSCO体系的自旋条纹序呈现出相对较长的单个畴区, 而\rmHBCO体系的自旋条纹序呈现出周期性且具有多个畴区, 表明\rmLSCO体系存在局域有序的自旋条纹序, \rmHBCO体系存在非局域长程有序的自旋条纹序. 更为重要的是, \rmHBCO超导材料中d波超导电子配对对称性的配对关联函数和有效配对关联函数在长程序上表现出明显的优势, 这说明长程有序的自旋条纹序有利于提高材料的超导电性, 即自旋条纹序和超导电性存在协同效应.

     

    To clarify the origin of the distinct superconducting transition temperatures in cuprate high-temperature superconductors and to elucidate the relationship between spin stripe order and superconductivity, we conduct large-scale, unbiased constrained-path quantum Monte Carlo simulations based on a two-orbital Hubbard model for copper oxides. We investigate the influences of the Cu \mathrmd_3z^2-r^2 orbital on the superconducting properties and spin stripe order in two prototypical cuprates, LSCO and HBCO.
    First, within the frame of square lattice models of sizes 8\times8 and 16\times16, we examine the effect of the Cu \mathrmd_3z^2-r^2 orbital on superconductivity, and simulate them by using the differences in orbital energy-level separations among different cuprate materials. The numerical results demonstrate that compared with LSCO, the HBCO exhibits that both the pairing correlation function and the effective pairing correlation function associated with d-wave superconducting symmetry are greatly enhanced. This result indicates that the higher superconducting transition temperature of HBCO than LSCO is closely related to the role of the Cu \mathrmd_3z^2-r^2 orbital.
    Second, as spin stripe order spontaneously breaks the rotational symmetry of the lattice and forms unidirectional, periodically modulated spin-density structures whose periodicity is generally incompatible with that of a square lattice, traditional periodic boundary conditions cannot accurately capture the intrinsic anisotropy of spin stripe order. To overcome this limitation, we use rectangular lattices in our numerical simulations to describe the spin stripe configurations. This approach allows for accommodating multiple stripe periods along the transverse direction, thereby faithfully capturing the spontaneously formed spin stripe structures in the electronic spin distribution and enabling the reliable analysis of their interplay with superconductivity. According to this approach, we investigate the formation of spin stripe order in LSCO and HBCO by using a 16\times4 rectangular lattice. The numerical results show that the LSCO develops relatively long single-domain spin stripes, whereas the HBCO exhibits periodic spin stripe structures consisting of multiple domains. These findings indicate that the LSCO possesses locally ordered spin stripes, while the HBCO supports a nonlocal, long-range ordered spin stripe order. More importantly, the pairing correlation function and effective pairing correlation function related to d-wave superconductivity in HBCO maintain an obvious long-range enhancement, demonstrating that long-range ordered spin stripes are beneficial for enhancing superconductivity. This result reveals a cooperative interplay between spin stripe order and superconductivity.
    Taken together, these results not only provide insight into the origin of the distinct superconducting transition temperatures in cuprate high-temperature superconductors and the correlations between different ordered phases, but also demonstrate that the Cu \mathrmd_3z^2-r^2 orbital plays a crucial role in tuning superconductivity and spin fluctuations in cuprate materials. Our study thus offers a new theoretical perspective for exploring strongly correlated cuprate systems.

     

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