Atomic modelling of point defects in B2-RuAl

Materials Science- Poland

Volumn 23, Issue 2, 2005, Pages 407-411

  Sot, Robert ^a,b   KurzydŁowski, Krzysztof J ^a  

^a WARSAW UNIVERSITY OF TECHNOLOGY   (Poland)

^b UNIVERSITY OF WARSAW   (Poland)

Author keywords

Ab initio calculations; Density functional calculations

Indexed keywords

APPROXIMATION THEORY; COMPUTATIONAL METHODS; CORROSION RESISTANCE; CRYSTAL ATOMIC STRUCTURE; CRYSTAL STRUCTURE; MATHEMATICAL MODELS; PARAMETER ESTIMATION; POINT DEFECTS; PROBABILITY DENSITY FUNCTION; THERMOOXIDATION;

AB INITIO CALCULATIONS; DENSITY FUNCTIONAL CALCULATIONS; SINGLE DEFECTS; STRUCTURAL PARAMETERS;

RUTHENIUM ALLOYS;

EID: 22944467523     PISSN: 01371339     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Conference Paper

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