Atomistic calculation of vacancy-formation free energies by reversible vacancy creation

Physical Review B - Condensed Matter and Materials Physics

Volumn 70, Issue 5, 2004, Pages

  De Koning, Maurice ^a   De Debiaggi, Susana Ramos ^b   Monti, Ana M ^c  

^a UNIVERSITY OF SÃO PAULO   (Brazil)

^b UNIVERSIDAD NACIONAL DEL COMAHUE   (Argentina)

^c DEPARTAMENTO DE FÍSICA   (Argentina)

Author keywords

[No Author keywords available]

Indexed keywords

ALLOY; NICKEL;

ARTICLE; ATOM; CRYSTAL STRUCTURE; ENERGY; ISOTHERM; MATHEMATICAL COMPUTING; MOLECULAR INTERACTION; SIMULATION; TEMPERATURE; THERMODYNAMICS;

EID: 42749103289     PISSN: 01631829     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevB.70.054105     Document Type: Article

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