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First-principles study of newly synthesized nanolaminate Mo2Ga2C

文献类型：期刊论文

作者Ling, Wei Dong1; Wei, Pan1; Duan, Ji Zheng2; Duan, Wen Shan1
刊名MODERN PHYSICS LETTERS B
出版日期2017-09-30
卷号31页码:10
关键词MAX phases first-principles calculations metallicity
ISSN号0217-9849
DOI10.1142/S0217984917502487
英文摘要Mo2Ga2C, which is a new member of MAX phases family discovered recently, has been regarded as the first compound of M(2)A(2)X family considering that no members of M(2)A(2)X phases have been found. Our work conducted first-principles calculations of new nanolaminate Mo2Ga2C followed by comparison with Mo-containing M(2)AX phases (Mo2GaC). Our results have shown that electric conductivity and ductile properties are greatly increased by adding Ca-layer, while theoretical hardness is retained. The Mo2Ga2C is found to possess more metallicity.
WOS关键词MAX PHASES ; M(N+1)AX(N) PHASES ; ELASTIC PROPERTIES ; CARBIDE ; CRYSTALS ; PROGRESS ; FAMILY
资助项目National Natural Science Foundation of China[11647313]
WOS研究方向Physics
语种英语
WOS记录号WOS:000411890800005
出版者WORLD SCIENTIFIC PUBL CO PTE LTD
资助机构National Natural Science Foundation of China
源URL[http://119.78.100.186/handle/113462/45797]  
专题中国科学院近代物理研究所
通讯作者Duan, Wen Shan
作者单位1.Northwest Normal Univ, Coll Phys & Elect Engn, Lanzhou 730070, Gansu, Peoples R China
2.Chinese Acad Sci, Inst Modern Phys, Lanzhou 730000, Gansu, Peoples R China
推荐引用方式
GB/T 7714		 Ling, Wei Dong,Wei, Pan,Duan, Ji Zheng,et al. First-principles study of newly synthesized nanolaminate Mo2Ga2C[J]. MODERN PHYSICS LETTERS B,2017,31:10.
APA Ling, Wei Dong,Wei, Pan,Duan, Ji Zheng,&Duan, Wen Shan.(2017).First-principles study of newly synthesized nanolaminate Mo2Ga2C.MODERN PHYSICS LETTERS B,31,10.
MLA Ling, Wei Dong,et al."First-principles study of newly synthesized nanolaminate Mo2Ga2C".MODERN PHYSICS LETTERS B 31(2017):10.

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来源：近代物理研究所

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