Concentration Dependence of Constituent Elements on Grain Boundary Migration in High-Entropy Alloys

被引：0

作者：

Shiotani, Kohei ^{[1
,2
]}

Niiyama, Tomoaki ^{[3
]}

Shimokawa, Tomotsugu ^{[3
]}

机构：

[1] Japan Atom Energy Agcy, Nucl Safety Res Ctr, Shirakata, Tokai 3191195, Japan

[2] Kanazawa Univ, Grad Sch Nat Sci & Technol, Div Mech Sci & Engn, Kakuma Machi, Kanazawa 9201192, Japan

[3] Kanazawa Univ, Inst Sci & Engn, Fac Mech Engn, Kakuma Machi, Kanazawa 9201192, Japan

来源：

MATERIALS TRANSACTIONS | 2025年 / 66卷 / 06期

关键词：

high-entropy alloy; grain boundary; grain boundary migration; segregation; pin-ning; molecular dynamics; GROWTH; DRAG;

D O I：

10.2320/matertrans.MT-Z2025001

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

High-entropy alloys (HEAs) are multicomponent alloys composed of five or more than five elements with near equimolar concentrations. In this study, molecular dynamics (MD) simulations of grain boundary (GB) migration in HEAs were performed in order to systematically investigate the concentration dependence of the constituent elements on its migration behavior. We found that the driving force required for GB migration in the model HEAs reaches the maximum when the GB migration becomes intermittent or the velocity reduces. The maximum driving force is achieved at the maximum degree of GB segregation, showing that GB segregation, which can be controlled by the element composition in the HEAs, strongly affects the GB migration behavior such as the required force for the migration and the velocity. Our study indicates that the element composition in HEAs plays an important role in determining the GB migration behavior and the obtained results contribute to designing the HEAs with superior mechanical properties.

引用

页码：704 / 711

页数：8

共 29 条

[11]

Hull D., 2011, Introduction to dislocations, V5th, DOI DOI 10.1016/B978-075064681-9/50003-1

[12] Recent Progress in Our Understanding of Phase Stability, Atomic Structures and Mechanical and Functional Properties of High-Entropy Alloys [J].

Inui, Haruyuki ;

Kishida, Kyosuke ;

Chen, Zhenghao .

MATERIALS TRANSACTIONS, 2022, 63 (03) :394-401

[13] Direct atomistic modeling of solute drag by moving grain boundaries [J].

Koju, R. K. ;

Mishin, Y. .

ACTA MATERIALIA, 2020, 198 (198) :111-120

[14] Robust structural identification via polyhedral template matching [J].

Larsen, Peter Mahler ;

Schmidt, Soren ;

Schiotz, Jakob .

MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING, 2016, 24 (05)

[15] Grain growth and the Hall-Petch relationship in a high-entropy FeCrNiCoMn alloy [J].

Liu, W. H. ;

Wu, Y. ;

He, J. Y. ;

Nieh, T. G. ;

Lu, Z. P. .

SCRIPTA MATERIALIA, 2013, 68 (07) :526-529

[16] THEORY OF IMPURITY CONTROLLED GRAIN BOUNDARY MOTION [J].

LUCKE, K ;

STUWE, HP .

ACTA METALLURGICA, 1971, 19 (10) :1087-&

[17] Emergence of near-boundary segregation zones in face-centered cubic multiprincipal element alloys [J].

McCarthy, Megan J. ;

Zheng, Hui ;

Apelian, Diran ;

Bowman, William J. ;

Hahn, Horst ;

Luo, Jian ;

Ong, Shyue Ping ;

Pan, Xiaoqing ;

Rupert, Timothy J. .

PHYSICAL REVIEW MATERIALS, 2021, 5 (11)

[18] A critical review of high entropy alloys and related concepts [J].

Miracle, D. B. ;

Senkov, O. N. .

ACTA MATERIALIA, 2017, 122 :448-511

[19] FAST PARALLEL ALGORITHMS FOR SHORT-RANGE MOLECULAR-DYNAMICS [J].

PLIMPTON, S .

JOURNAL OF COMPUTATIONAL PHYSICS, 1995, 117 (01) :1-19

[20] Mechanical properties of Nb25Mo25Ta25W25 and V20Nb20Mo20Ta20W20 refractory high entropy alloys [J].

Senkov, O. N. ;

Wilks, G. B. ;

Scott, J. M. ;

Miracle, D. B. .

INTERMETALLICS, 2011, 19 (05) :698-706

← 1 2 3 →