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Naji, M. |
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Motta, Antonella |
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Aletan, Dirar |
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Mohamed, Tarek |
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Ertürk, Emre |
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Taccardi, Nicola |
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Kononenko, Denys |
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Petrov, R. H. | Madrid |
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Alshaaer, Mazen | Brussels |
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Bih, L. |
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Casati, R. |
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Muller, Hermance |
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Kočí, Jan | Prague |
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Šuljagić, Marija |
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Kalteremidou, Kalliopi-Artemi | Brussels |
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Azam, Siraj |
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Ospanova, Alyiya |
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Blanpain, Bart |
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Ali, M. A. |
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Popa, V. |
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Rančić, M. |
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Ollier, Nadège |
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Azevedo, Nuno Monteiro |
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Landes, Michael |
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Rignanese, Gian-Marco |
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Jacques, Pascal, J.
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (12/12 displayed)
- 2024Friction Melt Bonding: an innovative process applied to the joining of dissimilar materials in a lap-joint configuration
- 2023A map of single-phase high-entropy alloyscitations
- 2022Shear banding-activated dynamic recrystallization and phase transformation during quasi-static loading of beta-metastable Ti-12 wt.% Mo alloycitations
- 2022Potential TRIP/TWIP coupled effects in equiatomic CrCoNi medium-entropy alloycitations
- 2022Optimisation of the Thermoelectric Properties of Fe2VAl Thin Films Obtained by Co-sputtering
- 2022Shear banding-activated dynamic recrystallization and phase transformation during quasi-static loading of β-metastable Ti – 12 wt % Mo alloy
- 2021Unveiling the thermodynamic driving forces for high entropy alloys formation through big data ab initio analysiscitations
- 2021Diffusion Multiples as a Tool to Efficiently Explore the Composition Space of High Entropy Alloyscitations
- 2021Influence of 5 at.%Al-Additions on the FCC to BCC Phase Transformation in CrFeNi Concentrated Alloyscitations
- 2020High temperature rise dominated cracking mechanisms in ultra-ductile and tough titanium alloycitations
- 2019A multi-mechanism non-local porosity model for high-ductile materials; application to high entropy alloys
- 2019Enhancement of toughness of Al-to-steel Friction Melt Bonded welds via metallic interlayerscitations
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article
Unveiling the thermodynamic driving forces for high entropy alloys formation through big data ab initio analysis
Abstract
The fundamental thermodynamic driving forces beyond the existence of high entropy alloys (HEAs) are still not firmly understood. Here, using thermodynamic modeling combining ab initio computations with a regular solution model, we build a database of more than 10 0,0 0 0 BCC and FCC equimolar alloys formed using 27 common elements. We statistically study how enthalpic and entropic contributions evolve with the number of elements in a random solid solution. The commonly admitted rationalization of a sta- bilization of HEAs due to a growing importance of the entropy with the number of elements is some- what contradicted. Entropic and enthalpic contributions favor mixing in average, but both driving forces weaken as the number of elements in the alloy increases. By adding binary intermetallics to our analysis, we conclude that the specific chemical compositions prone to form single phase HEAs need to combine an enthalpically favorable mixing of their elements on a given lattice with the absence of strongly com- peting intermetallics.