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Assessing the magnetic order dependent gamma-surface of Cr-Co-Ni alloys
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering. Shanghai Jiao Tong Univ, Sch Mat Sci & Engn, Shanghai Key Lab Adv High Temp Mat & Precis Formi, Shanghai 200240, Peoples R China..
KTH, School of Industrial Engineering and Management (ITM), Materials Science and Engineering, Properties.ORCID iD: 0000-0001-6482-1404
Northeastern Univ, Sch Mat Sci & Engn, Key Lab Anisotropy & Texture Mat, Minist Educ, Shenyang 110819, Peoples R China..ORCID iD: 0000-0002-6361-4785
Northeastern Univ, Sch Mat Sci & Engn, Key Lab Anisotropy & Texture Mat, Minist Educ, Shenyang 110819, Peoples R China..
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2021 (English)In: Journal of Materials Science & Technology, ISSN 1005-0302, Vol. 80, p. 66-74Article in journal (Refereed) Published
Abstract [en]

In order to efficiently explore the nearly infinite composition space in multicomponent solid solution alloys for reaching higher mechanical performance, it is important to establish predictive design strategies using computation-aided methods. Here, using ab initio calculations we systematically study the effects of magnetism and chemical composition on the generalized stacking fault energy surface (gamma-surface) of Cr-Co-Ni medium entropy alloys and show that both chemistry and the coupled magnetic state strongly affect the gamma-surface, consequently, the primary deformation modes. The relations among various stable and unstable stacking fault energies are revealed and discussed. The present findings are useful for studying the deformation behaviors of Cr-Co-Ni alloys and facilitate a density functional theory based design of transformation-induced plasticity and twinning-induced plasticity mechanisms in Cr-Co-Ni alloys.

Place, publisher, year, edition, pages
Elsevier BV , 2021. Vol. 80, p. 66-74
Keywords [en]
Cr-Co-Ni alloys, Stacking fault energy, Transformation-induced plasticity, Twinning-induced plasticity, Ab initio
National Category
Materials Chemistry
Identifiers
URN: urn:nbn:se:kth:diva-296668DOI: 10.1016/j.jmst.2020.10.078ISI: 000656122300007Scopus ID: 2-s2.0-85099196379OAI: oai:DiVA.org:kth-296668DiVA, id: diva2:1570735
Note

QC 20210622

Available from: 2021-06-22 Created: 2021-06-22 Last updated: 2022-06-25Bibliographically approved

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Yang, ZhibiaoLu, SongMao, HuahaiVitos, Levente

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