Abstract
This study presents a high-throughput, thermodynamics-guided framework for the discovery of novel magnetic high-entropy alloys (HEA). High-throughput CALPHAD simulations were employed to predict the equilibrium phases and Curie temperatures across a broad compositional space, including benchmark systems. The computational results were integrated with statistical data analysis to identify candidate compositions with optimal magnetic properties. The selected Fe42Co17Ni12Al17Cu6Ti6 HEA was fabricated by spark plasma sintering at various temperatures. For direct comparison, a reference Alnico 5 alloy was synthesized under the same processing conditions at 1273 K. The as-sintered HEA exhibited superior magnetic properties, with a maximum energy product (BHmax) of 4.4 kJ/m³ and coercivities (Hcj = 35.7 kA/m, Hcb = 33.4 kA/m) exceeding those of the Alnico 5 benchmark (BHmax = 3.3 kJ/m³, Hcj = 30.3 kA/m, Hcb = 27.9 kA/m). Furthermore, the HEA exhibited superior thermal stability, maintaining its remanence with a more gradual decline up to 1030 K, in contrast to Alnico 5, which underwent a rapid decrease above 870 K. This work establishes a versatile approach for accelerating the design of sustainable magnetic materials with tailored properties, effectively bridging high-throughput thermodynamic modeling and advanced manufacturing.
| Original language | English |
|---|---|
| Article number | 185342 |
| Journal | Journal of Alloys and Compounds |
| Volume | 1049 |
| DOIs | |
| Publication status | Published - 15 Dec 2025 |
UN SDGs
This output contributes to the following UN Sustainable Development Goals (SDGs)
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SDG 9 Industry, Innovation, and Infrastructure
Keywords
- CALPHAD
- High-entropy alloy
- High-throughput calculations
- Magnetic properties
- Microstructure
- Spark plasma sintering
- Thermodynamics
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