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Molecular dynamics simulations of La_2O_3 thin films on SiO_2
Mou Fang ; Stephen P.Kelty ; Xiangming He ; Mou Fang ; Stephen P. Kelty ; Xiangming He
2016-03-30 ; 2016-03-30
关键词molecular dynamics simulation heteroepitaxia thin film interface lattice mismatch equilibrium state TB383.2
其他题名Molecular dynamics simulations of La_2O_3 thin films on SiO_2
中文摘要Classical molecular dynamics is used to investigate the equilibrium state of the surface region and interface of heteroepitaxial La_2O_3 thin films.Due to the lattice mismatch,heteroepitaxial thin films are subject to very large stress.For this reason the behavior of La_2O_3 thin films at SiO_2interface becomes an important concern.Our result indicates that La_2O_3 can uniformly wet SiO_2 surface.The properties of the simulated films are analyzed and the lack of any discernible crystalline phase in epitaxial La_2O_3 on SiO_2 indicates that the lattice mismatch between SiO_2 and La_2O_3 is sufficiently large to prevent the formation of even short-range orders in La_2O_3 film.; Classical molecular dynamics is used to investigate the equilibrium state of the surface region and interface of heteroepitaxial La_2O_3 thin films.Due to the lattice mismatch,heteroepitaxial thin films are subject to very large stress.For this reason the behavior of La_2O_3 thin films at SiO_2interface becomes an important concern.Our result indicates that La_2O_3 can uniformly wet SiO_2 surface.The properties of the simulated films are analyzed and the lack of any discernible crystalline phase in epitaxial La_2O_3 on SiO_2 indicates that the lattice mismatch between SiO_2 and La_2O_3 is sufficiently large to prevent the formation of even short-range orders in La_2O_3 film.
语种英语 ; 英语
内容类型期刊论文
源URL[http://ir.lib.tsinghua.edu.cn/ir/item.do?handle=123456789/143999]  
专题清华大学
推荐引用方式
GB/T 7714
Mou Fang,Stephen P.Kelty,Xiangming He,et al. Molecular dynamics simulations of La_2O_3 thin films on SiO_2[J],2016, 2016.
APA Mou Fang,Stephen P.Kelty,Xiangming He,Mou Fang,Stephen P. Kelty,&Xiangming He.(2016).Molecular dynamics simulations of La_2O_3 thin films on SiO_2..
MLA Mou Fang,et al."Molecular dynamics simulations of La_2O_3 thin films on SiO_2".(2016).
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