Insulator-to-insulator transition and sign problem in the periodic Anderson model with a staggered potential

Motivated by the recent proposal that the Monte Carlo sign problem might be used as an indicator of quantum phase transitions, we simulate the periodic Anderson model at half-filling with a staggered ionic potential using the determinant quantum Monte Carlo (DQMC) approach. We observe a phase transition from a band insulator to a Kondo insulator as the hybridization increases. At finite temperature, an intermediate metallic region emerges between two insulating phases, which is characterized by a pseudogap in the spectral functions near the boundary of the intermediate region and a quasiparticle peak in the middle. The latter coincides with a crossing point of the $f$-electron occupation on different sublattices as well as the maximum antiferromagnetic (AFM) correlations. The metallic region extrapolates to a single quantum critical point at zero temperature, which may result in exotic quasiparticle excitations associated with the emergent metallic state. The Monte Carlo sign problem is found to be most pronounced in the quantum critical region, implying a close connection between the two phenomena. Our results are qualitatively supported by the Hartree-Fock (HF) mean-field calculations. Our work reveals interesting physics in inhomogeneous Kondo lattice systems that may be worthwhile of more investigations in the future.

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Publication Details

Journal
Physical review. B./Physical review. B
Published
2024-11-07
DOI
https://doi.org/10.1103/physrevb.110.195122
Primary Topic
Rare-earth and actinide compounds
Type
article
Field-Weighted Citation Impact
0.00

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article

Insulator-to-insulator transition and sign problem in the periodic Anderson model with a staggered potential

Mengfan Wang, Yi‐feng Yang, Danqing Hu
Physical review. B./Physical review. B
Rare-earth and actinide compounds
article

Insulator-to-insulator transition and sign problem in the periodic Anderson model with a staggered potential

Mengfan Wang, Yi‐feng Yang, Danqing Hu
article en

Abstract

Motivated by the recent proposal that the Monte Carlo sign problem might be used as an indicator of quantum phase transitions, we simulate the periodic Anderson model at half-filling with a staggered ionic potential using the determinant quantum Monte Carlo (DQMC) approach. We observe a phase transition from a band insulator to a Kondo insulator as the hybridization increases. At finite temperature, an intermediate metallic region emerges between two insulating phases, which is characterized by a pseudogap in the spectral functions near the boundary of the intermediate region and a quasiparticle peak in the middle. The latter coincides with a crossing point of the $f$-electron occupation on different sublattices as well as the maximum antiferromagnetic (AFM) correlations. The metallic region extrapolates to a single quantum critical point at zero temperature, which may result in exotic quasiparticle excitations associated with the emergent metallic state. The Monte Carlo sign problem is found to be most pronounced in the quantum critical region, implying a close connection between the two phenomena. Our results are qualitatively supported by the Hartree-Fock (HF) mean-field calculations. Our work reveals interesting physics in inhomogeneous Kondo lattice systems that may be worthwhile of more investigations in the future.

Physical review. B./Physical review. BVol. 110(19)
Chongqing University (CN), Chinese Academy of Sciences (CN), Songshan Lake Materials Laboratory (CN), FZU ‒ Institute of Physics of the Academy of Sciences of the Czech Republic (CZ), Institute of Physics (CN), University of Chinese Academy of Sciences (CN)
Chongqing Postdoctoral Science Foundation, National Natural Science Foundation of China, Chinese Academy of Sciences, National Key Research and Development Program of China
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Rare-earth and actinide compounds
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