| First-principles study on the effects of twin boundaries on anodic dissolution of Mg | |
| Ma, Hui1,2; Liu, Min1,2; Chen, Weiliang1,2,3; Wang, Changgang1,2; Chen, Xing-Qiu1,2; Dong, Junhua1,2; Ke, Wei1,2 | |
| Corresponding Author | Chen, Xing-Qiu(xingqiu.chen@imr.ac.cn) ; Dong, Junhua(jhdong@imr.ac.cn) |
| 2019-05-17 | |
| Source Publication | PHYSICAL REVIEW MATERIALS
 |
| ISSN | 2475-9953 |
| Volume | 3Issue:5Pages:11 |
| Abstract | Known experiments revealed that various deformation-induced defects in wrought Mg-based alloys indeed accelerate the corrosion rate. In particular, for Mg-based alloys the twinning mode under plastic deformation is the usually and more easily occurring one than other defects. However, to date it has been very difficult to study the specific effect of twin boundaries (TBs) on the corrosion behavior of Mg-based alloys due to the coexistence of other defects in wrought alloy. Here, through first-principles calculations we have theoretically investigated the effects of TBs on the anodic dissolutions of Mg metal. It has been found that the presence of various TBs (TB1{10 (1) over bar1}[1 (2) over bar 10], TB2 {10 (1) over bar2}[1 (2) over bar 10], or TB3 {10 (1) over bar3}[1 (2) over bar 10]) accelerates the corrosion rate and the TB-induced accelerations of the corrosion current density are indeed correlated with the TB interfacial length per area. Physically, the existence of the TBs on the specified surfaces increases the surface energy density, which implies that atoms at various TB-containing surfaces become less stable in energy as compared with the TB-free surface. In addition, we have analyzed that some alloying elements (As, Cd, Hg, Zn, and Sn) in combination with TBs can reduce the anodic dissolution rate, potentially enhancing the corrosion resistance of Mg-based alloys. |
| Funding Organization | National Science Fund for Distinguished Young Scholars ; National Key Research and Development Program of China |
| DOI | 10.1103/PhysRevMaterials.3.053806 |
| Indexed By | SCI |
| Language | 英语 |
| Funding Project | National Science Fund for Distinguished Young Scholars[51725103] ; National Key Research and Development Program of China[2017YFB0702302] ; [TZ2016004] |
| WOS Research Area | Materials Science |
| WOS Subject | Materials Science, Multidisciplinary |
| WOS ID | WOS:000468238100005 |
| Publisher | AMER PHYSICAL SOC |
| Citation statistics | |
| Document Type | 期刊论文 |
| Identifier | http://ir.imr.ac.cn/handle/321006/133517 |
| Collection | 中国科学院金属研究所 |
| Corresponding Author | Chen, Xing-Qiu; Dong, Junhua |
| Affiliation | 1.Chinese Acad Sci, Inst Met Res, Environm Corros Ctr, Shenyang 110016, Peoples R China 2.Chinese Acad Sci, Inst Met Res, Shenyang Natl Lab Mat Sci SYNL, Shenyang 110016, Peoples R China 3.Northeastern Univ, Sch Met, Shenyang 110819, Liaoning, Peoples R China |
| Recommended Citation GB/T 7714 | Ma, Hui,Liu, Min,Chen, Weiliang,et al. First-principles study on the effects of twin boundaries on anodic dissolution of Mg[J]. PHYSICAL REVIEW MATERIALS,2019,3(5):11. |
| APA | Ma, Hui.,Liu, Min.,Chen, Weiliang.,Wang, Changgang.,Chen, Xing-Qiu.,...&Ke, Wei.(2019).First-principles study on the effects of twin boundaries on anodic dissolution of Mg.PHYSICAL REVIEW MATERIALS,3(5),11. |
| MLA | Ma, Hui,et al."First-principles study on the effects of twin boundaries on anodic dissolution of Mg".PHYSICAL REVIEW MATERIALS 3.5(2019):11. |
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