Vacancy-Formation Thermodynamics in Aluminium and Nickel: A Computational Study

Defect and Diffusion Forum

Volumn 224-225, Issue , 2004, Pages 59-74

  De Koning, M ^a   Ramos de Debiaggi, S ^b   Monti, A M ^c  

^a UNIVERSITY OF SÃO PAULO   (Brazil)

^b UNIVERSIDAD NACIONAL DEL COMAHUE   (Argentina)

^c DEPARTAMENTO DE FÍSICA   (Argentina)

Author keywords

Anharmonic Effects; Free Energy; Point Defects; Reversible Work; Thermodynamic Integration

Indexed keywords

COMPUTER SIMULATION; ENTHALPY; ENTROPY; FREE ENERGY; HARDENING; HIGH TEMPERATURE EFFECTS; MOLECULAR DYNAMICS; MONTE CARLO METHODS; NICKEL; POINT DEFECTS; THERMODYNAMICS;

ANHARMONIC EFFECTS; HARMONIC APPROXIMATION; MECHANICAL HARDENING; THERMODYNANMIC INTEGRATION; VACANCY-FORMATION;

ALUMINUM;

EID: 0347603457     PISSN: 10120386     EISSN: 16629507     Source Type: Journal    
DOI: 10.4028/www.scientific.net/ddf.224-225.59     Document Type: Article

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