Short-range ordering governs brittleness and ductility in W-Ta solid solution: Insights from Pugh's shear-to-bulk modulus ratio

Short-range ordering governs brittleness and ductility in W-Ta solid solution: Insights from Pugh's shear-to-bulk modulus ratio
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短程有序控制 W-Ta 固溶体的脆性和延展性:Pugh 剪切与体积模量比的见解

DOI:
10.1016/j.scriptamat.2021.114136
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发表时间:
2021-07-17
期刊:
影响因子:
6
通讯作者:
Liang, Chaoping
Liang, Chaoping
中科院分区:
材料科学1区
文献类型:
--
作者:
Liu, Honggang;Tang, Sai;Liang, Chaoping

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In this work, the effect of short-range ordering on the intrinsic brittleness and ductility deduced from Pugh's shear-to-bulk modulus (G/B) ratio in W-Ta solid solution is investigated by first-principles calculation. The results show that the G/B value, an indicator of brittleness, decreases as a function of Ta concentration in W-Ta solid solution. The short-range ordered structure displays a ductile behavior in comparison to ideal solid solution and atomic segregated structure in terms of G/B value. This ductility of short-range ordered structure originates from the reduction of the number of partially covalent W-W bonds and a centrosymmetric screening of W-W interactions in W-Ta solid solution. Our findings suggest that short-range ordering should play a role in the solid solution softening and irradiation hardening phenomenon in W solid solution, and could be included in the future design of ductile W alloys. (c) 2021 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.