The impact of chemical short-range order on the thermophysical properties of medium- and high-entropy alloys
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Contributors
Abstract
The unusual behavior observed in the coefficient of thermal expansion and specific heat capacity of CrFeNi, CoCrNi, and CoCrFeNi medium/high-entropy alloys is commonly referred to as the K-state effect. It is shown to be independent of the Curie temperature, as demonstrated by temperature-dependent magnetic moment measurements. CoCrFeNi alloy is chosen for detailed characterization; potential reasons for the K-state effect such as texture, recrystallization, and second-phase precipitation are ruled out. An examination of the electronic structure indicates the formation of a pseudo-gap in the Density of States, which suggests a specific chemical interaction between Ni and Cr atoms upon alloying. Hybrid Monte Carlo/Molecular Dynamic (MC/MD) simulations indicate the presence of non-negligible chemical short-range order (CSRO). Local lattice distortions are shown to be negligible, although deviations around Cr and Ni elements from those expected in a fully disordered structure are experimentally observed by X-ray absorption spectroscopy. The determined bonding distances are in good agreement with MC/MD calculations. A mechanism is proposed to explain the anomalies and calorimetric experiments and their results are used to validate the mechanism.
Details
Original language | English |
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Article number | 112724 |
Journal | Materials and Design |
Volume | 238 |
Publication status | Published - Feb 2024 |
Peer-reviewed | Yes |
Keywords
ASJC Scopus subject areas
Keywords
- Chemical short-range order, Differential scanning calorimetry, Dilatometry, High-entropy alloys, Order-disorder effects