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Intrinsic strain-induced segregation in multiply twinned Cu-Pt icosahedra

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成果类型:
期刊论文
作者:
Deng, Lei;Liu, Xunlin;Zhang, Xingming*;Wang, Liang;Li, Wei;...
通讯作者:
Zhang, Xingming;Tang, Jianfeng
作者机构:
[Zhang, XM; Tang, Jianfeng; Deng, Lei; Li, Wei; Liu, Xunlin; Wang, Liang; Song, Mingke; Zhang, Xingming] Hunan Agr Univ, Coll Sci, Changsha 410128, Hunan, Peoples R China.
[Deng, Huiqiu; Hu, Wangyu] Hunan Univ, Coll Mat Sci & Engn, Changsha 410082, Hunan, Peoples R China.
[Xiao, Shifang] Hunan Univ, Sch Phys & Elect, Changsha 410082, Hunan, Peoples R China.
通讯机构:
[Zhang, XM; Tang, JF] H
Hunan Agr Univ, Coll Sci, Changsha 410128, Hunan, Peoples R China.
语种:
英文
期刊:
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
ISSN:
1463-9076
年:
2019
卷:
21
期:
9
页码:
4802-4809
基金类别:
National Natural Science Foundation of ChinaNational Natural Science Foundation of China (NSFC) [51301066, 51501063, 11802092]; Changsha Municipal Science and Technology Program [kq1801022]; Undergraduate Innovation Experiment Program of Hunan Agricultural University [XCX17100]; Natural Science Foundation of Hunan Agricultural University [16QN13]
机构署名:
本校为第一且通讯机构
院系归属:
理学院
摘要:
We present an atomistic simulation study on the compositional arrangements throughout Cu-Pt icosahedra, with a specific focus on the effects of inherent strain on general segregation trends. The coexistence of radial and site-selective segregation patterns is found in bimetallic nanoparticles for a broad range of sizes and compositions, consistent with prior analytical and atomistic models. Through a thorough comparison between the composition patterns and strain-related patterns, it is suggested that the presence of gradient and site-selective segregation is natural to largely relieve the inh...

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