Skalenübergreifende Modellierung und Optimierung vom atomistischen kristallinen Phasenfeldmodell bis zur mesoskopischen Phasenfeldmethode

Expansion of the phase field crystal model for multi-component mixtures, as ternary dendritic and lamellar eutectic crystallization. Comparison of crystal growth with molecular dynamics and phase field simulations. Parameters and initial data structures are used to simulate, starting from a small at...

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Auteur principal: Berghoff, Marco
Format: Online
Langue:allemand
Publié: KIT Scientific Publishing 2021
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Accès en ligne:34920
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Description
Résumé:Expansion of the phase field crystal model for multi-component mixtures, as ternary dendritic and lamellar eutectic crystallization. Comparison of crystal growth with molecular dynamics and phase field simulations. Parameters and initial data structures are used to simulate, starting from a small atom cluster to a ternary dendrites with side arms. Optimization techniques to reduce the amount of computation are developed.