Response of fcc metals and L12 and D022 type trialuminides to uniaxial loading along [100] and [001]: Ab initio DFT calculations

Philosophical Magazine

Volumn 91, Issue 4, 2011, Pages 491-516

  Jahnatek M ^a   Krajci M ^a,b   Hafner, J ^a  

^a UNIVERSITY OF VIENNA   (Austria)

^b INSTITUTE OF PHYSICS   (Slovakia)

Author keywords

computer simulation; intermetallics; mechanical properties; strengthening mechanisms; stress strain diagram; transition metal compounds

Indexed keywords

AB INITIO; ATOMIC PLANES; CRITICAL STRAINS; DEFORMATION PATH; DENSITY-FUNCTIONAL CALCULATIONS; DFT CALCULATION; FACE-CENTRED CUBIC; FCC METALS; PURE METALS; SHEAR INSTABILITY; SPECIAL STRUCTURE; STRENGTHENING MECHANISMS; STRESS-STRAIN DIAGRAM; TENSION AND COMPRESSION; TRIALUMINIDES; UNI-AXIAL COMPRESSION; UNI-AXIAL LOADING; UNI-AXIAL STRAINS;

ALUMINUM; BIFURCATION (MATHEMATICS); COMPUTATIONAL METHODS; COMPUTER SIMULATION; CRYSTAL STRUCTURE; DEFORMATION; EPITAXIAL GROWTH; INTERMETALLICS; LOADING; MECHANICAL PROPERTIES; METALS; SCANDIUM; STRENGTHENING (METAL); STRESS-STRAIN CURVES; STRESSES; TENSILE STRENGTH;

STRAIN;

EID: 78751545008     PISSN: 14786435     EISSN: 14786443     Source Type: Journal    
DOI: 10.1080/14786435.2010.523720     Document Type: Article

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