Microscopic simulation of stacking fault energy and mechanical properties in CrCoNiAl <sub> <i>x</i> </sub> Ti <sub> <i>y</i> </sub> high-entropy alloys
DFT, MD, and ML reveal how Al/Ti doping tunes SFE and mechanical properties in CrCoNi-based HEAs.
Authors
- Siying Liu (ORCID: https://orcid.org/0000-0002-3689-8110)
- Cheng Lian (ORCID: https://orcid.org/0000-0002-9016-832X)
- Jinkai Qiu (ORCID: https://orcid.org/0000-0003-3361-3674)
- Xian‐Cheng Zhang (ORCID: https://orcid.org/0000-0003-4128-7602)
- Yuzhu Zhao (ORCID: https://orcid.org/0009-0001-9593-9605)
- Tiwen Lu
- Honglai Liu
- Mengde Kang
Institutions
- East China University of Science and Technology (CN)
- State Key Laboratory of Chemical Engineering (CN)
Publication Details
- Journal
- Journal of Materials Chemistry A
- Published
- 2025-01-01
- DOI
- https://doi.org/10.1039/d5ta04257g
- Primary Topic
- High Entropy Alloys Studies
- Type
- article
- Field-Weighted Citation Impact
- 0.00
Funders
- National Natural Science Foundation of China
- National Key Research and Development Program of China