First-principles study of Ti3AC2 (A = Si, Al) (0 0 1) surfaces

Acta Materialia

Volumn 55, Issue 14, 2007, Pages 4645-4655

  Zhang, H Z ^a,b   Wang, S Q ^a  

^a INSTITUTE OF METAL RESEARCH   (China)

^b UNIVERSITY OF CHINESE ACADEMY OF SCIENCES   (China)

Author keywords

Ceramic; DFT; Surface energy; Surface stability; Ti3SiC2

Indexed keywords

SURFACE STABILITY; TI-SI BOND; TI3SIC2;

CERAMIC MATERIALS; CHEMICAL BONDS; DENSITY FUNCTIONAL THEORY; INTERFACIAL ENERGY;

TITANIUM COMPOUNDS;

EID: 34447333414     PISSN: 13596454     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.actamat.2007.04.033     Document Type: Article

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