Core structure of a screw dislocation in Ti from density functional theory and classical potentials

Acta Materialia

Volumn 60, Issue 3, 2012, Pages 1287-1292

  Ghazisaeidi, M ^a   Trinkle, D R ^b  

^a UNIVERSITY OF ILLINOIS AT URBANA CHAMPAIGN   (United States)

^b University of Illinois at Urbana Champaign   (United States)

Author keywords

Core structure; Density functional theory; Dislocations; Plastic deformation; Titanium

Indexed keywords

APPLIED STRAIN; CORE ENERGY; CORE STRUCTURE; DENSITY FUNCTIONALS; DISLOCATION LINES; EMBEDDED ATOMS; HIGH ENERGY; INITIAL POSITION; LOW ENERGIES; STACKING FAULT ENERGIES;

DENSITY FUNCTIONAL THEORY; DISLOCATIONS (CRYSTALS); PLASTIC DEFORMATION; SCREWS; TITANIUM;

SCREW DISLOCATIONS;

EID: 83655183398     PISSN: 13596454     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.actamat.2011.11.024     Document Type: Article

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