TY - JOUR
T1 - Thermodynamics-guided high-throughput discovery of magnetic high-entropy alloys fabricated by spark plasma sintering at different temperatures
AU - Sanchez, Jon Mikel
AU - Lagos, Miguel A.
AU - Garcia, Jose Carlos
AU - Leizaola, Iñaki
AU - Fernández, Blanca Luna Checa
AU - Rivera, Christian
N1 - Publisher Copyright:
© 2025 The Authors
PY - 2025/12/15
Y1 - 2025/12/15
N2 - 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.
AB - 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.
KW - CALPHAD
KW - High-entropy alloy
KW - High-throughput calculations
KW - Magnetic properties
KW - Microstructure
KW - Spark plasma sintering
KW - Thermodynamics
UR - https://www.scopus.com/pages/publications/105023713359
U2 - 10.1016/j.jallcom.2025.185342
DO - 10.1016/j.jallcom.2025.185342
M3 - Article
AN - SCOPUS:105023713359
SN - 0925-8388
VL - 1049
JO - Journal of Alloys and Compounds
JF - Journal of Alloys and Compounds
M1 - 185342
ER -