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1. Carbide Formation in Refractory Mo15Nb20Re15Ta30W20 Alloy under a Combined High-Pressure and High-Temperature Condition

   https://doi.org/10.3390/e22070718  

   Zhang, Congyan ; Bhandari, Uttam ; Zeng, Congyuan ; Ding, Huan ; Guo, Shengmin ; Yan, Jinyuan ; Yang, Shizhong ( July 2020 , Entropy)

   null (Ed.)

   In this work, the formation of carbide with the concertation of carbon at 0.1 at.% in refractory high-entropy alloy (RHEA) Mo15Nb20Re15Ta30W20 was studied under both ambient and high-pressure high-temperature conditions. The x-ray diffraction of dilute carbon (C)-doped RHEA under ambient pressure showed that the phases and lattice constant of RHEA were not influenced by the addition of 0.1 at.% C. In contrast, C-doped RHEA showed unexpected phase formation and transformation under combined high-pressure and high-temperature conditions by resistively employing the heated diamond anvil cell (DAC) technique. The new FCC_L12 phase appeared at 6 GPa and 809 °C and preserved the ambient temperature and pressure. High-pressure and high-temperature promoted the formation of carbides Ta3C and Nb3C, which are stable and may further improve the mechanical performance of the dilute C-doped alloy Mo15Nb20Re15Ta30W20. 

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2. Twinning-induced strain hardening in dual-phase FeCoCrNiAl0.5 at room and cryogenic temperature

   https://doi.org/10.1038/s41598-018-28784-1  

   Bönisch, M. ; Wu, Y. ; Sehitoglu, H. ( July 2018 , Scientific Reports)

   A face-centered-cubic (fcc) oriented FeCoCrNiAl_0.5dual-phase high entropy alloy (HEA) was plastically strained in uniaxial compression at 77K and 293K and the underlying deformation mechanisms were studied. The undeformed microstructure consists of a body-centered-cubic (bcc)/B2 interdendritic network and precipitates embedded in 〈001〉-oriented fcc dendrites. In contrast to other dual-phase HEAs, at both deformation temperatures a steep rise in the stress-strain curves occurs above 23% total axial strain. As a result, the hardening rate associated saturates at the unusual high value of ~6 GPa. Analysis of the strain partitioning between fcc and bcc/B2 by digital image correlation shows that the fcc component carries the larger part of the plastic strain. Further, electron backscatter diffraction and transmission electron microscopy evidence ample fcc deformation twinning both at 77K and 293K, while slip activity only is found in the bcc/B2. These results may guide future advancements in the design of novel alloys with superior toughening characteristics.

    

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3. Insights on phase formation from thermodynamic calculations and machine learning of 2436 experimentally measured high entropy alloys

   https://doi.org/10.1016/j.jallcom.2022.165173  

   Wang, Chuangye ; Zhong, Wei ; Zhao, Ji-Cheng ( September 2022 , Journal of Alloys and Compounds)

   Both CALPHAD (CALculation of PHAse Diagrams) and machine-learning (ML) approaches were employed to analyze the phase formation in 2,436 experimentally measured high entropy alloy (HEA) compositions consisting of various quinary mixtures of Al, Co, Cr, Cu, Fe, Mn, and Ni. CALPHAD was found to have good capabilities in predicting the BCC/B2 and FCC phase formation for the 1,761 solid-solution-only compositions, excluding HEAs containing an amorphous phase (AM) or/and intermetallic compound (IM). Phase selection rules were examined systematically using several parameters and it revealed that valency electron concentration (VEC) < 6.87 and VEC > 9.16 are the conditions for the formation of single-phase BCC/B2 and FCC, respectively; and CALPHAD could predict this with essentially 100% accuracy. Both CALPHAD predictions and experimental observations show that more BCC/B2 alloys are formed over FCC alloys as the atomic size difference between the elements increases. Four machine learning (ML) algorithms, decision tree (DT), k-nearest neighbor (KNN), support vector machine (SVM), and artificial neural network (ANN), were employed to study the phase selection rules for two different datasets, one consisting of 1,761 solid-solution (SS) HEAs without AM and/or IM phases, and the other set consisting of all the 2,436 HEA compositions. Cross validation (CV) was performed to optimize the ML models and the CV accuracies are found to be 91.4%, 93.1%, 90.2%, 89.1% for DT, KNN, SVM, and ANN respectively in predicting the formation of BCC/B2, BCC/B2 + FCC, and FCC; and 93.6%, 93.3%, 95.5%, 92.7% for DT, KNN, SVM, and ANN respectively in predicting SS, AM, SS + AM, and IM phases. Sixty-six experimental bulk alloys with SS structures are predicted with trained ANN model, and the accuracy reaches 81.8%. VEC is found to be most important parameter in phase prediction for BCC/B2, BCC/B2 + FCC, and FCC phases. Electronegativity difference and FCC-BCC-index (FBI) are the two additional dominating features in determining the formation of SS, AM, SS + AM, and IM. A separation line ΔH_mix=28.97×VEC-246.77 was found in the VEC-vs-ΔH_mix plot to predict the formation of single-phase BCC/B2 or FCC with a 96.2% accuracy (ΔH_mix = mixing enthalpy). These insights will be very valuable for designing HEAs with targeted crystal structures. 

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4. Recent Progress with BCC-Structured High-Entropy Alloys

   https://doi.org/10.3390/met12030501  

   Liu, Fangfei ; Liaw, Peter K. ; Zhang, Yong ( March 2022 , Metals)

   High-entropy alloys (HEAs) prefer to form single-phase solid solutions (body-centered cubic (BCC), face-centered cubic (FCC), or hexagonal closed-packed (HCP)) due to their high mixing entropy. In this paper, we systematically review the mechanical behaviors and properties (such as oxidation and corrosion) of BCC-structured HEAs. The mechanical properties at room temperature and high temperatures of samples prepared by different processes (including vacuum arc-melting, powder sintering and additive manufacturing) are compared, and the effect of alloying on the mechanical properties is analyzed. In addition, the effects of HEA preparation and compositional regulation on corrosion resistance, and the application of high-throughput techniques in the field of HEAs, are discussed. To conclude, alloy development for BCC-structured HEAs is summarized. 

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5. Phase transition kinetics of superionic H2O ice phases revealed by Megahertz X-ray free-electron laser-heating experiments

   https://doi.org/10.1038/s41467-024-52505-0  

   Husband, R_J ; Liermann, H_P ; McHardy, J_D ; McWilliams, R_S ; Goncharov, A_F ; Prakapenka, V_B ; Edmund, E. ; Chariton, S. ; Konôpková, Z. ; Strohm, C. ; et al ( September 2024 , Nature Communications)

   H₂O transforms to two forms of superionic (SI) ice at high pressures and temperatures, which contain highly mobile protons within a solid oxygen sublattice. Yet the stability field of both phases remains debated. Here, we present the results of an ultrafast X-ray heating study utilizing MHz pulse trains produced by the European X-ray Free Electron Laser to create high temperature states of H₂O, which were probed using X-ray diffraction during dynamic cooling. We confirm an isostructural transition during heating in the 26-69 GPa range, consistent with the formation of SI-bcc. In contrast to prior work, SI-fcc was observed exclusively above ~50 GPa, despite evidence of melting at lower pressures. The absence of SI-fcc in lower pressure runs is attributed to short heating timescales and the pressure-temperature path induced by the pump-probe heating scheme in which H₂O was heated above its melting temperature before the observation of quenched crystalline states, based on the earlier theoretical prediction that SI-bcc nucleates more readily from the fluid than SI-fcc. Our results may have implications for the stability of SI phases in ice-rich planets, for example during dynamic freezing, where the preferential crystallization of SI-bcc may result in distinct physical properties across mantle ice layers.

    

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