Characterizing the three-orbital Hubbard model with determinant quantum Monte Carlo
Abstract
We report a Determinant Quantum Monte Carlo investigation which quantifies the behavior of the susceptibility and the entropy in the framework of the periodic Anderson model (PAM), focusing on the evolution with different degree of conduction electron (c) local moment (f) hybridization. These results capture the behavior observed in several experiments, including the universal behavior of the NMR Knight shift anomaly below the crossover temperature, T . We find that T is a measure of the onset of cf correlations and grows with increasing hybridization. These results suggest that the NMR Knight shift and spinlattice relaxation rate measurements in nonFermi liquid materials are strongly influenced by temperaturedependent hybridization processes. Our results provide a microscopic basis for the phenomenological twofluid model of Kondo lattice behavior, and its evolution with pressure and temperature.
- Authors:
-
- Stanford Univ., Stanford, CA (United States); SLAC National Accelerator Lab., Menlo Park, CA (United States)
- Argonne National Lab. (ANL), Argonne, IL (United States); Univ. of Alabama, Birmingham, AL (United States)
- SLAC National Accelerator Lab., Menlo Park, CA (United States); Stanford Univ., Stanford, CA (United States)
- Stanford Univ., Stanford, CA (United States); SLAC National Accelerator Lab., Menlo Park, CA (United States); Cornell Univ., Ithaca, NY (United States)
- SLAC National Accelerator Lab., Menlo Park, CA (United States); Univ. of North Dakota, Grand Forks, ND (United States)
- Univ. of California, Davis, CA (United States)
- Univ. of Tennessee, Knoxville, TN (United States)
- Publication Date:
- Research Org.:
- SLAC National Accelerator Laboratory (SLAC), Menlo Park, CA (United States); Univ. of California, Davis, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES); USDOE National Nuclear Security Administration (NNSA); National Science Foundation (NSF)
- OSTI Identifier:
- 1256712
- Alternate Identifier(s):
- OSTI ID: 1250190; OSTI ID: 1361069
- Report Number(s):
- SLAC-PUB-16554
Journal ID: ISSN 2469-9950; PRBMDO
- Grant/Contract Number:
- AC02-76SF00515; AC02-06CH11357; Er-046169; AC02-05CH11231; 1147470; NA0002908
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Physical Review B
- Additional Journal Information:
- Journal Volume: 93; Journal Issue: 15; Journal ID: ISSN 2469-9950
- Publisher:
- American Physical Society (APS)
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSICS; 97 MATHEMATICS AND COMPUTING; 72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS
Citation Formats
Kung, Y. F., Chen, C. -C., Wang, Yao, Huang, E. W., Nowadnick, E. A., Moritz, B., Scalettar, R. T., Johnston, S., and Devereaux, T. P. Characterizing the three-orbital Hubbard model with determinant quantum Monte Carlo. United States: N. p., 2016.
Web. doi:10.1103/PhysRevB.93.155166.
Kung, Y. F., Chen, C. -C., Wang, Yao, Huang, E. W., Nowadnick, E. A., Moritz, B., Scalettar, R. T., Johnston, S., & Devereaux, T. P. Characterizing the three-orbital Hubbard model with determinant quantum Monte Carlo. United States. https://doi.org/10.1103/PhysRevB.93.155166
Kung, Y. F., Chen, C. -C., Wang, Yao, Huang, E. W., Nowadnick, E. A., Moritz, B., Scalettar, R. T., Johnston, S., and Devereaux, T. P. Fri .
"Characterizing the three-orbital Hubbard model with determinant quantum Monte Carlo". United States. https://doi.org/10.1103/PhysRevB.93.155166. https://www.osti.gov/servlets/purl/1256712.
@article{osti_1256712,
title = {Characterizing the three-orbital Hubbard model with determinant quantum Monte Carlo},
author = {Kung, Y. F. and Chen, C. -C. and Wang, Yao and Huang, E. W. and Nowadnick, E. A. and Moritz, B. and Scalettar, R. T. and Johnston, S. and Devereaux, T. P.},
abstractNote = {We report a Determinant Quantum Monte Carlo investigation which quantifies the behavior of the susceptibility and the entropy in the framework of the periodic Anderson model (PAM), focusing on the evolution with different degree of conduction electron (c) local moment (f) hybridization. These results capture the behavior observed in several experiments, including the universal behavior of the NMR Knight shift anomaly below the crossover temperature, T . We find that T is a measure of the onset of cf correlations and grows with increasing hybridization. These results suggest that the NMR Knight shift and spinlattice relaxation rate measurements in nonFermi liquid materials are strongly influenced by temperaturedependent hybridization processes. Our results provide a microscopic basis for the phenomenological twofluid model of Kondo lattice behavior, and its evolution with pressure and temperature.},
doi = {10.1103/PhysRevB.93.155166},
journal = {Physical Review B},
number = 15,
volume = 93,
place = {United States},
year = {Fri Apr 29 00:00:00 EDT 2016},
month = {Fri Apr 29 00:00:00 EDT 2016}
}
Web of Science
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