First-principles study of oxygen atom adsorption on γ-TiAl(111) surface

Jinshu Xuebao/Acta Metallurgica Sinica

Volumn 42, Issue 9, 2006, Pages 897-902

  Li, Hong ^a   Liu, Limin ^a   Wang, Shaoqing ^a   Ye, Hengqiang ^a  

^a INSTITUTE OF METAL RESEARCH   (China)

Author keywords

TiAl; Adsorption energy; Chemical potential; First principles; Oxidation; Surface energy

Indexed keywords

ADSORPTION; ATOMS; CHEMICAL BONDS; CHEMISORPTION; ELECTRONIC STRUCTURE; INTERFACIAL ENERGY; OXIDATION; OXYGEN; TITANIUM ALLOYS;

ADSORPTION ENERGY; CHEMICAL POTENTIAL; FIRST-PRINCIPLES; GAMMA-TIAL; SURFACE ENERGY;

ALUMINUM ALLOYS;

EID: 33751099068     PISSN: 04121961     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

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