DFT studies of sulfur induced stress corrosion cracking in nickel

Computational Materials Science

Volumn 44, Issue 4, 2009, Pages 1236-1242

  Kart, H H ^a,b   Uludogan, M ^b   Cagin, T ^b  

^a PAMUKKALE UNIVERSITY   (Turkey)

^b Texas AandM University   (United States)

Author keywords

Ab initio calculation; Density functional theory; Grain boundary segregation; Grain boundary structure; Nickel; Stress corrosion cracking

Indexed keywords

ATOMIC PHYSICS; ATOMS; CORROSION; CRACKING (CHEMICAL); DENSITY FUNCTIONAL THEORY; GRAIN BOUNDARIES; GRAIN SIZE AND SHAPE; NICKEL; NICKEL ALLOYS; PROGRAMMING THEORY; RESIDUAL STRESSES; SEGREGATION (METALLOGRAPHY); SULFUR;

AB-INITIO CALCULATION; GRAIN BOUNDARY SEGREGATION; GRAIN BOUNDARY STRUCTURE; IMPURITY ATOMS; SULFUR ATOMS; TILT GRAIN BOUNDARY;

STRESS CORROSION CRACKING;

EID: 58549098888     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2008.08.007     Document Type: Article

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