Structural, elastic and electronic properties of intermetallics in the Pt-Sn system: A density functional investigation

Computational Materials Science

Volumn 46, Issue 4, 2009, Pages 921-931

  Zhou, Wei ^a,b   Liu, Lijuan ^a,b   Li, Baoling ^a,b   Wu, Ping ^a,b   Song, Qinggong ^c  

^a TIANJIN UNIVERSITY   (China)

^b Tianjin Key Laboratory of Low Dimensional Materials Physics and Preparing Technology   (China)

^c CIVIL AVIATION UNIVERSITY OF CHINA   (China)

Author keywords

Elasticity; Electronic structure; First principles calculations; Intermetallics

Indexed keywords

A-DENSITY; BINARY SYSTEMS; DIRECTIONAL DEPENDENCE; ELASTIC ANISOTROPY; ELASTIC PROPERTIES; ELECTRONIC NATURES; FIRST PRINCIPLES CALCULATIONS; FIRST-PRINCIPLES CALCULATION; MECHANICALLY STABLE; POLYCRYSTALLINE; YOUNG'S MODULUS;

ANISOTROPY; ELASTIC CONSTANTS; ELASTICITY; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; INTERMETALLICS; PLATINUM; TIN;

DENSITY FUNCTIONAL THEORY;

EID: 70249111116     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2009.04.044     Document Type: Article

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