Award Abstract # 2316831
LEAPS-MPS: Exploring New Materials for Efficient Waste-Heat Conversion

NSF Org: DMR
Division Of Materials Research
Recipient: KETTERING UNIVERSITY
Initial Amendment Date: May 31, 2023
Latest Amendment Date: May 31, 2023
Award Number: 2316831
Award Instrument: Standard Grant
Program Manager: Alexios Klironomos
aklirono@nsf.gov
 (703)292-4920
DMR
 Division Of Materials Research
MPS
 Directorate for Mathematical and Physical Sciences
Start Date: July 1, 2023
End Date: June 30, 2026 (Estimated)
Total Intended Award Amount: $249,999.00
Total Awarded Amount to Date: $249,999.00
Funds Obligated to Date: FY 2023 = $249,999.00
History of Investigator:
  • Demet Usanmaz (Principal Investigator)
    dusanmaz@kettering.edu
Recipient Sponsored Research Office: Kettering University
1700 University Ave
Flint
MI  US  48504-6214
(810)762-9677
Sponsor Congressional District: 08
Primary Place of Performance: Kettering University
1700 University Ave
Flint
MI  US  48504-6214
Primary Place of Performance
Congressional District:
08
Unique Entity Identifier (UEI): C8K8EGHC6CW9
Parent UEI:
NSF Program(s): LEAPS-MPS
Primary Program Source: 01002324DB NSF RESEARCH & RELATED ACTIVIT
Program Reference Code(s): 7569, 8084, 8396, 8611
Program Element Code(s): 217Y00
Award Agency Code: 4900
Fund Agency Code: 4900
Assistance Listing Number(s): 47.049

ABSTRACT

NONTECHNICAL SUMMARY

This LEAPS-MPS award supports computational research and education activities with an aim to develop a systematic approach for designing new "thermoelectric" materials, which can create electricity from heat. Good thermoelectric materials conduct electricity well, but they should also be poor conductors of heat, a combination which is challenging to achieve simultaneously. The global energy need is increasing rapidly, and searching for new materials to enable efficient, environment-friendly, and durable technologies for clean energy production and conservation requires urgent attention. Today, more than 60% of the energy generated by nonrenewable sources becomes waste heat, which can be scavenged with thermoelectric technology. Advancement in such technologies requires the design and discovery of new high-performance thermoelectric materials. In this project, the PI and her team will use state-of-the-art computational methods to search for new thermoelectric materials, in which heat and electronic transport can effectively be decoupled from each other to enable efficient generation of electricity while the material remains thermally insulating. This award also supports the training of undergraduate and master's students in computational materials science. The PI will partner with various programs at Kettering University to reach out to underrepresented minority as well as K-12 students and recruit them to work on the project.

TECHNICAL SUMMARY

This LEAPS-MPS award supports computational research and education activities with an aim to develop a systematic approach for designing new high-performance thermoelectric materials. Advancement in thermoelectric technology depends on identifying new materials with high efficiency by using novel approaches to design new materials to minimize strong interdependency between different features, such as electrical conductivity, thermal conductivity, and Seebeck coefficient. These include large dataset screening and advanced thermodynamic, electronic, and structural property investigations. Using high-throughput density functional theory calculations and cluster expansion methods, the PI and her team will investigate whether self-assembled nanostructures based on topological materials can be found that would allow electron and phonon transport decoupling to improve thermoelectric efficiency. The main idea is to find appropriate matching materials with a small energy barrier and lattice continuity between the nanostructure and the parent material, which would help in retaining high carrier mobility while scattering phonons to enhance thermoelectric performance. This award also supports the training of undergraduate and master's students in computational materials science. The PI will partner with various programs at Kettering University to reach out to underrepresented minority as well as K-12 students and recruit them to work on the project.

This award reflects NSF's statutory mission and has been deemed worthy of support through evaluation using the Foundation's intellectual merit and broader impacts review criteria.

Please report errors in award information by writing to: awardsearch@nsf.gov.

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