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Variational Monte Carlo study of the nematic state in iron-pnictide superconductors with a five-orbital model
Authors:Zheng Xiao-Jun  Huang Zhong-Bing  Zou Liang-Jian
Affiliation:a Key Laboratory of Materials Physics, Institute of Solid State Physics, Chinese Academy of Sciences, Hefei 230031, China;b Faculty of Physics and Electronic Technology, Hubei University, Wuhan 430062, China;c Beijing Computational Science Research Center, Beijing 100084, China;d Department of Physics, University of Science and Technology of China, Hefei 230026, China
Abstract:
We perform a variational Monte Carlo study of the nematic state in iron-pnictide superconductors within a realistic five-orbital model.Our numerical results show that the nematic state,formed by introducing an anisotropic hopping order into the projected wave function,is not stable unless the off-site Coulomb interaction V exceeds a critical value.This demonstrates that V plays a key role in forming the nematic state in iron-pnictide superconductors.In the nematic state,the orbital order and the anisotropic spin correlations are consistent with the experimental observations.We argue that the experimentally observed anisotropic magnetic couplings and structural transition are associated with the nematic state and can be understood in a unified framework.
Keywords:iron-pnictide superconductors  nematic state  off-site Coulomb interaction  variational Monte Carlo simulation
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