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高温超导 cuprate 三维轨道模型的相图。

Phase diagram of a three-orbital model for high-Tc cuprate superconductors.

机构信息

King's College London, Theory and Simulation of Condensed Matter (TSCM), The Strand, London WC2R 2LS, United Kingdom and Thomas Young Centre, University College London, 17 Gordon Street, London WC1H 0AH, United Kingdom.

DPMC-MaNEP, University of Geneva, 24 Quai Ernest-Ansermet, CH-1211 Geneva, Switzerland.

出版信息

Phys Rev Lett. 2014 Mar 21;112(11):117001. doi: 10.1103/PhysRevLett.112.117001. Epub 2014 Mar 18.

Abstract

We study the phase diagram of an effective three-orbital model of the cuprates using variational Monte Carlo calculations on asymptotically large lattices and exact diagonalization on a 24-site cluster. States with ordered orbital current loops (LC), itinerant antiferromagnetism, d-wave superconductivity, and the Fermi liquid are investigated using appropriate Slater determinants refined by Jastrow functions for on-site and intersite correlations. We find an LC state stable in the thermodynamic limit for a range of parameters compatible with the Fermi surface of a typical hole doped superconductor provided the transfer integrals between the oxygen atoms have signs determined by the effects of indirect transfer through the Cu-4s orbitals as suggested by Andersen. The results of the calculations are that the LC phase gives way at lower dopings to an antiferromagnetism phase, and at larger dopings to superconductivity and Fermi liquid phases.

摘要

我们使用变分蒙特卡罗计算和 24 点簇的精确对角化方法,研究了铜氧化物的有效三轨道模型的相图。使用合适的 Slater 行列式,通过对局域和局间关联的 Jastrow 函数进行细化,研究了具有有序轨道电流环 (LC)、巡游反铁磁序、d 波超导性和费米液体的状态。我们发现,对于一组与典型空穴掺杂超导体的费米面兼容的参数,在热力学极限下 LC 状态是稳定的,前提是氧原子之间的转移积分具有 Andersen 所提出的通过 Cu-4s 轨道间接转移效应所确定的符号。计算结果表明,在较低掺杂下,LC 相转变为反铁磁相,在较大掺杂下转变为超导相和费米液体相。

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