Award Abstract # 1609560
RUI: Disorder in Strongly-Correlated Electrons on a Lattice

NSF Org: DMR
Division Of Materials Research
Recipient: SAN JOSE STATE UNIVERSITY RESEARCH FOUNDATION
Initial Amendment Date: November 15, 2016
Latest Amendment Date: November 15, 2016
Award Number: 1609560
Award Instrument: Standard Grant
Program Manager: Daryl Hess
dhess@nsf.gov
 (703)292-4942
DMR
 Division Of Materials Research
MPS
 Directorate for Mathematical and Physical Sciences
Start Date: December 1, 2016
End Date: November 30, 2019 (Estimated)
Total Intended Award Amount: $171,000.00
Total Awarded Amount to Date: $171,000.00
Funds Obligated to Date: FY 2017 = $171,000.00
History of Investigator:
  • Ehsan Khatami (Principal Investigator)
    ehsan.khatami@sjsu.edu
Recipient Sponsored Research Office: San Jose State University Foundation
210 N 4TH ST FL 4
SAN JOSE
CA  US  95112-5569
(408)924-1400
Sponsor Congressional District: 18
Primary Place of Performance: San Jose State University
One Washington Square
San Jose
CA  US  95192-0106
Primary Place of Performance
Congressional District:
Unique Entity Identifier (UEI): LJBXV5VF2BT9
Parent UEI: LJBXV5VF2BT9
NSF Program(s): CONDENSED MATTER & MAT THEORY
Primary Program Source: 01001718DB NSF RESEARCH & RELATED ACTIVIT
Program Reference Code(s): 9229, 9216, 8614, 7237, 7433, 8084
Program Element Code(s): 176500
Award Agency Code: 4900
Fund Agency Code: 4900
Assistance Listing Number(s): 47.049

ABSTRACT

NONTECHNICAL SUMMARY

This award supports theoretical research and education in the physics of disorder and its effect on how electrons organize in real materials. Theoretical study and understanding of fundamental properties of solids that exhibit unexpected and often technologically useful properties at low temperatures commonly rely on the assumption that atoms form perfectly periodic lattices. However, disorder (crystal defects or impurities) that exists in real materials cannot always be ignored when studying electronic properties. Together with all the other important players in the system (crystal lattice geometry, interaction between electrons, etc.), their presence can drive the system as a whole to phases that do not appear if one considers disorder alone, or only electronic interactions. The accurate description of such an inclusive system using current numerical techniques can be a daunting task.

In this project, the PI will implement a novel idea for efficiently taking random disorder into account in certain numerical simulations of interacting electrons. The PI will use the method to study the collective rearrangements of electrons and the different transformations they can undergo. The results will help interpret experimental observations, and will ultimately help understand the mechanism behind the creation of exotic phases, such as insulating and superconducting phases, with possible applications in the technology and energy sectors.

The activities will provide several undergraduate students from the diverse population of San Jose State University with hands-on research experience in the field of computational condensed matter physics, and with opportunities to improve their scientific communication skills through writing papers and presenting their findings at national scientific meetings. The award also supports the PI in his efforts to integrate research and undergraduate education through the incorporation of computational methods into physics courses.

TECHNICAL SUMMARY

This award supports theoretical research and education in the physics of disorder and its effect on electronic phase transitions. The interplay of disorder, caused by impurities or crystal defects in real materials, and electronic correlations in condensed matter physics is only poorly understood. Important questions about the effect of disorder on the appearance and nature of phase transitions, as well as on the fate of the Anderson localization upon introduction of electronic interactions in different dimensions, remain largely unsettled. This is especially true for fermionic systems and the corresponding quantum lattice models that emulate disorder effects through random-site or bond energies. Recent experiments with ultracold Fermi gasses on optical lattices have begun to shed light on some of these questions. However, much like in experimental simulations with clean lattices, these experiments rely on approximation-free and highly precise numerical simulations for thermometry and characterization.

In this project the PI will implement a new idea for the treatment of continuous random disorder in the numerical linked-cluster expansion, an emerging and powerful method that yields exact finite-temperature results for strongly correlated electronic systems in the thermodynamic limit. Using this method, the PI will study the thermodynamic properties, including various magnetic and/or superconducting correlations of Heisenberg and Hubbard models in two and three dimensions. The results will improve our understanding of the exotic phenomena that can arise in the presence of both disorder and electronic correlations, and will help interpret results of future experiments with disordered optical lattices. The data obtained, especially in the strong-coupling regimes, can also be used to benchmark other numerical methods for disordered fermionic systems.

The activities will provide several undergraduate students from the diverse population of San Jose State University with hands-on research experience in the field of computational condensed matter physics, and with opportunities to improve their scientific communication skills through writing papers and presenting their findings at national scientific meetings. The award also supports the PI in his efforts to integrate research and undergraduate education through the incorporation of computational methods into physics courses.

PUBLICATIONS PRODUCED AS A RESULT OF THIS RESEARCH

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(Showing: 1 - 10 of 16)
Ch'ng, Kelvin and Vazquez, Nick and Khatami, Ehsan "Unsupervised machine learning account of magnetic transitions in the Hubbard model" Phys. Rev. E , v.97 , 2018 , p.013306 10.1103/PhysRevE.97.013306
Yi Zhang and A. Mesaros and K. Fujita and S. D. Edkins and M. H. Hamidian and K. Ch'ng and H. Eisaki and S. Uchida and J. C. S\'{e}amus Davis and E. Khatami and Eun-Ah Kim "Machine Learning in Electronic Quantum Matter Imaging Experiments" Nature , v.570 , 2019 , p.484 10.1038/s41586-019-1319-8
Shaozhi Li, Philip M. Dee, Ehsan Khatami, and Steven Johnston "Accelerating lattice quantum Monte Carlo simulation using artificial neural networks: an application to the Holstein model" Phys. Rev. B , v.100 , 2019 , p.020302 10.1103/PhysRevB.100.020302
Michael Mulanix and Demetrius Almada and Ehsan Khatami "Numerical linked-cluster expansions for disordered lattice models" Phys. Rev. B , v.99 , 2019 , p.205113 10.1103/PhysRevB.99.205113
Matthew A. Nichols and Lawrence W. Cheuk and Melih Okan and Thomas R. Hartke and Enrique Mendez and T. Senthil and Ehsan Khatami and Hao Zhang and Martin W. Zwierlein "Spin Transport in a Mott Insulator of Ultracold Fermions" Science , v.363 , 2019 , p.383 10.1126/science.aat4387
Li, Shaozhi and Khatami, Ehsan and Johnston, Steven "Competing phases and orbital-selective behaviors in the two-orbital Hubbard-Holstein model" Phys. Rev. B , v.95 , 2017 , p.121112 10.1103/PhysRevB.95.121112
Li, Shaozhi and Khatami, Ehsan and Johnston, Steven "Competing phases and orbital-selective behaviors in the two-orbital Hubbard-Holstein model" Phys. Rev. B , v.95 , 2017 , p.121112 10.1103/PhysRevB.95.121112
Kristopher McBrian and Giuseppe Carleo and Ehsan Khatami "Ground state phase diagram of the one-dimensional Bose-Hubbard model from restricted Boltzmann machines" J of Physics Conference Series , v.1290 , 2019 , p.012005 10.1088/1742-6596/1290/1/012005
Krishnakumar Bhattaram and Ehsan Khatami "Lanczos boosted numerical linked-cluster expansion for quantum lattice models" Phys. Rev. E , v.100 , 2019 , p.013305 10.1103/PhysRevE.100.013305
Guo, Huaiming and Khatami, Ehsan and Wang, Yao and Devereaux, Thomas P. and Singh, Rajiv R. P. and Scalettar, Richard T. "Unconventional pairing symmetry of interacting Dirac fermions on a $\ensuremath{\pi}$-flux lattice" Phys. Rev. B , v.97 , 2018 , p.155146 10.1103/PhysRevB.97.155146
Ehsan Khatami "Principal component analysis of the magnetic transition in the three-dimensional Fermi-Hubbard model" J of Physics Conference Series , v.1290 , 2018 , p.012006 10.1088/1742-6596/1290/1/012006
(Showing: 1 - 10 of 16)

PROJECT OUTCOMES REPORT

Disclaimer

This Project Outcomes Report for the General Public is displayed verbatim as submitted by the Principal Investigator (PI) for this award. Any opinions, findings, and conclusions or recommendations expressed in this Report are those of the PI and do not necessarily reflect the views of the National Science Foundation; NSF has not approved or endorsed its content.

Crystal defects or impurities, collectively referred to as disorder, in solids can affect their electronic properties in nontrivial ways. The theoretical models we use to gain insight into the collective properties of electrons moving around and interacting with each other in solids, including their tendency to organize themselves in ways that give rise to macroscopically interesting phenomena, such as magnetism or superconductivity, are often constructed in clean and homogeneous environments. This is partly because treating disorder effects on the same footing as all the other important players in an interacting electronic system is very challenging for the vast majority of the numerical methods we use to study those models. In this project, we developed and implemented algorithms based on a numerical method that can already produce exact results for such systems in the clean limit to extend its applicability to systems with disorder. Given the extent of randomness introduced to model parameters due to a certain type of disorder present in the system, we can obtain exact properties such as the heat capacity, magnetization, or the tendency for the system to change its phase, at a range of finite temperatures relevant to experimental realizations. Our results have helped to improve our understanding of how disorder, in the presence interactions, modifies the temperature-dependent collective electronic character of quantum materials.

The project created opportunities for undergraduate and Masters students from the diverse population of San Jose State University, including six from groups historically underrepresented in physics, to engage in research activities, including computer programming, presentation of their findings at conferences, and co-authorship of scientific papers. Traveling to meetings, conferences and workshops for the dissemination of the results obtained for this project, facilitated PI's collaborations, including several with experimental groups, and significantly improved the PI's engagement in his professional field. Sixteen peer-reviewed publications, including three published in journals of Science and Nature, were produced, made possible at least in part due to support from this grant. Activities supported by this grant also promoted building capacity for high-performance computing facilities at the PI's institution.


Last Modified: 03/30/2020
Modified by: Ehsan Khatami

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