Stability, elastic properties and electronic structures of the stable Zr-Al intermetallic compounds: A first-principles investigation

Journal of Alloys and Compounds

Volumn 590, Issue , 2014, Pages 50-60

  Duan, Y H ^a,b   Huang, B ^a   Sun, Y ^a   Peng, M J ^a   Zhou, S G ^a  

^a KUNMING UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

^b BEIJING UNIVERSITY OF POSTS AND TELECOMMUNICATIONS   (China)

Author keywords

Elastic properties; Electronic structures; First principles; Phase stability; Zr Al compounds

Indexed keywords

BINARY INTERMETALLIC COMPOUNDS; BONDING CHARACTERISTICS; ELASTIC PROPERTIES; ENTHALPIES OF FORMATION; FIRST-PRINCIPLES; FIRST-PRINCIPLES CALCULATION; FIRST-PRINCIPLES INVESTIGATIONS; ZR-AL COMPOUNDS;

ALUMINUM; ANISOTROPY; CALCULATIONS; ELASTICITY; ELECTRONIC STRUCTURE; ENTHALPY; PHASE STABILITY;

ZIRCONIUM;

EID: 84891810692     PISSN: 09258388     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jallcom.2013.12.079     Document Type: Article

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