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Award Abstract # 1534534
DMREF: Accelerating the Development of High Temperature Shape Memory Alloys

NSF Org: CMMI
Division of Civil, Mechanical, and Manufacturing Innovation
Recipient: TEXAS A&M ENGINEERING EXPERIMENT STATION
Initial Amendment Date: August 27, 2015
Latest Amendment Date: September 11, 2018
Award Number: 1534534
Award Instrument: Standard Grant
Program Manager: Mary Toney
CMMI
 Division of Civil, Mechanical, and Manufacturing Innovation
ENG
 Directorate for Engineering
Start Date: September 1, 2015
End Date: August 31, 2019 (Estimated)
Total Intended Award Amount: $1,467,133.00
Total Awarded Amount to Date: $1,667,133.00
Funds Obligated to Date: FY 2015 = $1,467,133.00
FY 2018 = $200,000.00
History of Investigator:
  • Raymundo Arroyave (Principal Investigator)
    rarroyave@tamu.edu
  • Dimitris Lagoudas (Co-Principal Investigator)
  • Edward Dougherty (Co-Principal Investigator)
  • Ibrahim Karaman (Co-Principal Investigator)
  • Ahmed-Amine Benzerga (Co-Principal Investigator)
Recipient Sponsored Research Office: Texas A&M Engineering Experiment Station
3124 TAMU
COLLEGE STATION
TX  US  77843-3124
(979)862-6777
Sponsor Congressional District: 10
Primary Place of Performance: Texas Engineering Experiment Station
TEES State Headquarters
College Station
TX  US  77845-4645
Primary Place of Performance
Congressional District:
10
Unique Entity Identifier (UEI): QD1MX6N5YTN4
Parent UEI: QD1MX6N5YTN4
NSF Program(s): DMREF
Primary Program Source: 01001516DB NSF RESEARCH & RELATED ACTIVIT
01001819DB NSF RESEARCH & RELATED ACTIVIT
Program Reference Code(s): 024E, 054Z, 7433, 8021, 8400, 9102
Program Element Code(s): 829200
Award Agency Code: 4900
Fund Agency Code: 4900
Assistance Listing Number(s): 47.041

ABSTRACT

High Temperature Shape Memory Alloys (HTSMAs) are alloys that exhibit large shape changes at high stresses and high temperatures. If the shape change behavior had be controlled and tailored, HTSMAs can be used as robust and compact solid-state actuators with performance exceeding any other current technology. Since the behavior of HTSMAs is highly dependent on chemistry and processing, tailoring of HTSMAs for specific applications using solely experimental means is unrealistic. This award supports the development of a framework that can allow for the design of chemistry and processing steps to achieve a given performance requirement in these materials. The immediate technological impact of the work is the accelerated development of high-temperature solid-state actuators for the aerospace and automotive industries. Furthermore, the award will expose seven graduate and two to four undergraduate students to a highly interdisciplinary research project, combining ideas from materials science, mechanics, computer science, machine learning and design. The work supports efforts related to the Materials Genome Initiative by integrating experimental and computational research, making digital data accessible, and training the future workforce.

The current investigators and their collaborators have recently discovered that nano-recipitation in NiTiHf HTSMAs leads to unprecedented cyclic stability with reversible phase transformation under significant stresses at elevated temperatures. To accelerate their development, this research team will develop a framework to prescribe the necessary initial composition and subsequent processing schedule of a NiTiHf HTSMA based on arbitrary performance requirements: A two-level physically rigorous modeling approach links chemistry and processing to performance. The first modeling level connects chemistry and processing through a precipitation model, while the second level connects microstructure to shape memory response through a thermodynamics-based micromechanics formulation. Within a Bayesian framework, models are initially calibrated using prior knowledge about the likely value of their parameters. Calibrated models are in turn used to design optimal experiments, that maximize the utility of experiments in terms of information gain or desired materials response, that then lead to enhanced model refinement and predictability. Models are in turn used to optimize shape memory response by prescribing feasible composition plus processing sets taking into account uncertainty in model parameters and heterogeneities in microstructure. The overall framework will be disseminated through conventional channels, while the models, model parameters and data generated through this research will be made available to the wider scientific community through an instance of the Materials Data Curation System developed by the National Institute of Standards and Technology.

PUBLICATIONS PRODUCED AS A RESULT OF THIS RESEARCH

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(Showing: 1 - 10 of 47)
Abu-Odeh, A., E. Galvan, T. Kirk, Huahai Mao, Q. Chen, P. Mason, R. Malak, and R. Arróyave "Efficient exploration of the High Entropy Alloy composition-phase space" Acta Materialia , v.152 , 2018 , p.41 10.1016/j.actamat.2018.04.012
Abu-Odeh, A., Galvan, E., Kirk, T., Mao, H., Chen, Q., Mason, P., Malak, R. and Arróyave, R. "Efficient exploration of the High Entropy Alloy composition-phase space" Acta Materialia , v.152 , 2018 , p.41 10.1016/j.actamat.2018.04.012
A. Cox, B. Franco, S. Wang, Th. Baxevanis, I. Karaman and D. Lagoudas "Predictive modeling of the constitutive response of precipitation hardened Ni-rich NiTi SMAs" Shape Memory and Superelasticity , v.3.1 , 2017 , p.9 2199-3858
Arróyave, R. and McDowell, D.L "Systems Approaches to Materials Design: Past, Present, and Future" Annual Review of Materials Research , v.49 , 2019 10.1146/annurev-matsci-070218-125955
Arróyave, R., Talapatra, A., Johnson, L., Singh, N., Ma, J., & Karaman, I. "Computational thermodynamics and kinetics-based ICME framework for high-temperature shape memory alloys" Shape Memory and Superelasticity , v.1 , 2015 , p.429 2199-3858
Attari, V., Cruzado, A. and Arroyave, R. "Exploration of the microstructure space in TiAlZrN ultra-hard nanostructured coatings" Acta Materialia , v.174 , 2019 , p.459 10.1016/j.actamat.2019.05.047
Boluki, S., Dadaneh, S.Z., Qian, X. and Dougherty, E.R. "Optimal clustering with missing values" BMC bioinformatics , v.20 , 2019 , p.321 10.1089/106652799318274
Boluki, Shahin, Mohammad Shahrokh Esfahani, Xiaoning Qian, and Edward R. Dougherty. "Incorporating biological prior knowledge for Bayesian learning via maximal knowledge-driven information priors" BMC bioinformatics , v.18 , 2018 , p.552 10.1186/s12859-017-1893-4
Boluki, S., Qian, X. and Dougherty, E.R. "Experimental design via generalized mean objective cost of uncertainty" IEEE Access , v.7 , 2018 , p.2223 10.1109/ACCESS.2018.2886576
Chaudhary, N., Abu-Odeh, A., Karaman, I., & Arróyave, R. "A data-driven machine learning approach to predicting stacking faulting energy in austenitic steels" Journal of Materials Science , v.52 , 2017 , p.11048 0022-2461
Cox, A., B. Franco, S. Wang, T. Baxevanis, I. Karaman, and D. C. Lagoudas "Predictive modeling of the constitutive response of precipitation hardened Ni-rich NiTi" Shape Memory and Superelasticity , v.3 , 2017 , p.9 10.1007/s40830-016-0096-6
(Showing: 1 - 10 of 47)

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.

High-temperature Shape Memory Alloys (HTSMAs) can enable smart actuation of components at elevated temperatures. They can potentially replace expensive, heavy and bulky hydraulic actuators in aerospace vehicles and can enable next-generation capabilities such as wing morphing and active reconfiguration of aerospace systems. Unfortunately, HTSMAs are extremely sensitive to chemistry and processing and their optimization requires considerable experimental and computational efforts, making progress towards optimal HTSMAs extremely slow.

To address this problem, a highly interdisciplinary team with expertise in computational materials science, micromechanics, machine learning, design as well as experimental synthesis and characterization tackled the problem by combining materials science tools with powerful machine learning frameworks.

In this project, the team developed an interdisciplinary framework to accelerate the discovery and design of next-generation HTSMAs based on the Ni-Ti-Hf system. New models and simulations tools were used to better predict the effect of chemistry and processing on the mechanical response of these active materials. Additionally, the team developed entirely new frameworks for the design of HTSMAs with specific active response through the use of Bayesian Optimization approaches. These methods are common in machine learning as they provide the means to optimize the respone of an Artificial Intelligence system with minimal data and are thus especially suited to the materials discovery problem, which is time consuming and quite resource intensive. 

The project resulted in a wealth of data on the effect of chemistry and processing on the response of HTSMAs, in addition to more powerful computational models and materials discovery and design frameworks. A major achievement of this project was the discovery of the HTSMA with the lowest hysteresis measured to date. Students and postdoctoral scholars involved in this project were trained in a number of interdisciplinary skills and in some cases participated in an interdisciplinary graduate program on materials science, informatics and design. 

 


Last Modified: 12/23/2019
Modified by: Raymundo Arroyave

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