Multiscale simulations on the coarsening of Cu-rich precipitates in α-Fe using kinetic Monte Carlo, molecular dynamics and phase-field simulations

Acta Materialia

Volumn 60, Issue 20, 2012, Pages 6961-6971

  Molnar, David ^a   Mukherjee, Rajdip ^b,c   Choudhury, Abhik ^b   Mora, Alejandro ^a   Binkele, Peter ^a   Selzer, Michael ^b,c   Nestler, Britta ^b,c   Schmauder, Siegfried ^a  

^a UNIVERSITY OF STUTTGART   (Germany)

^b KARLSRUHE INSTITUTE OF TECHNOLOGY   (Germany)

^c KARLSRUHE UNIVERSITY OF APPLIED SCIENCES   (Germany)

Author keywords

Kinetic Monte Carlo; Molecular dynamics; Multiscale; Phase field methods; Precipitation

Indexed keywords

CALPHAD; COARSENING KINETICS; COARSENING RATES; FE-CU ALLOYS; GIBBS-THOMSON; INTERFACE ENERGY; KINETIC MONTE CARLO; KINETIC MONTE CARLO SIMULATION; MOLECULAR DYNAMICS SIMULATIONS; MULTI-SCALE SIMULATION; MULTISCALES; PHASE FIELD METHODS; PHASE-FIELD SIMULATION; POTENTIAL FORMULATIONS; PRECIPITATE VOLUME FRACTION; SYSTEM EVOLUTION;

COARSENING; KINETICS; MOLECULAR DYNAMICS; PHASE TRANSITIONS; PRECIPITATION (CHEMICAL); RATE CONSTANTS; SHAPE OPTIMIZATION; THERMOELECTRICITY;

PRECIPITATES;

EID: 84868203553     PISSN: 13596454     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.actamat.2012.08.051     Document Type: Article

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