Journal of Japan Institute of Copper
Online ISSN : 2435-872X
Print ISSN : 1347-7234
Simulation
Co Effect in the Precipitation Behavior in Cu-Ni-Si Alloy
Eun-Ae ChoiSeung Zeon HanJee Hyuk AhnSatoshi SemboshiJehyun LeeSung Hwan Lim
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2022 Volume 61 Issue 1 Pages 279-283

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Abstract

We investigated Co effect in precipitation behavior in Cu–Ni–Si alloy by analyzing the cohesive and interfacial energies of the second phase doped with Co based on the density functional theory (DFT) calculations. Co atoms are expected to reduce the cohesive energy of Ni2Si, but increase the interfacial energy between Cu and Ni2Si, resulting in the increment of the activation energy of Ni2Si precipitation. Higher activation energy of (Ni,Co)2Si precipitation leads a higher aging temperature or a longer aging time for precipitation compared to Cu–Ni–Si alloy. The experimental results and DFT calculation have a good agreement. And the DFT calculations predict that aspect ratio of (Ni1x,Cox)2Si precipitates decreases according to Co concentration. Besides, experiments show that the precipitates in Cu–Ni–Co–Si alloy changed to a more spherical shape not only in the matrix but also at the grain boundary.

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© 2022 Japan Institute of Copper
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