Rapid Design of Cost-Effective Refractory High Entropy Alloys Strengthened by Precipitation

Conference · Tue Aug 20 04:00:00 EDT 2024

DOI:https://doi.org/10.2172/2568413· OSTI ID:2568413

Gao, Michael ^[1]; Alman, David ^[1]; San, Saro ^[2]; Trehern, William ^[1]; Sudbrack, Chantal ^[1]; Jablonski, Paul ^[1]; Raghuraman, Vishnu ^[3]; Widom, Mike ^[3]; Thapliyal, Saket ^[4]; Kirka, Michael ^[4]

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1. NETL
2. National Energy Technology Laboratory (NETL)
3. Carnegie Mellon University (CMU)
4. Oak Ridge National Laboratory (ORNL)

Funded by the ARPA-E ULTIMATE program, this project aims to develop cost-effective refractory high entropy alloys (RHEAs) for gas turbine blades applications at 1300 degree Celsius and above. The alloy design focuses on carbides precipitation strengthening in a strong and ductile solid solution BCC matrix. The goal is to achieve balanced mechanical properties including room temperature ductility & fracture toughness and high temperature strength and creep resistance, while maintaining comparable oxidation resistance and densities to Ni-base superalloys. To accelerate alloy design, multiscale modeling including CALPHAD and first-principles density functional theory (DFT) calculations and machine learning are performed. Specifically, high throughput phase diagram calculations and screening are carried out using CALPHAD; DFT calculations are performed to predict intrinsic ductility, grain boundary strengthening potential, coefficient of thermal expansion (CTE) and temperature-dependent elastic constants. Temperature dependent yield stress, creep strain and CTE are also predicted using machine learning. Down-selected alloys are synthesized in small buttons of about 250g using arc melting for rapid evaluation on microstructure and mechanical properties before employing plasma arc melting and additive manufacturing for producing large ingots. Preliminary computational and experimental results of this project will be presented and future direction in RHEA development will be discussed.

• Research Organization: National Energy Technology Laboratory (NETL), Pittsburgh, PA, Morgantown, WV, and Albany, OR (United States)
• Sponsoring Organization: USDOE Office of Fossil Energy and Carbon Management (FECM)
• OSTI ID: 2568413
• Country of Publication: United States
• Language: English

Related Subjects

high temperature materials
mechanical properties
multiscale modeling