Phase-field modeling for ferroelectrics
Benjamin M. Völker
Broschiertes Buch

Phase-field modeling for ferroelectrics

in a multi-scale approach

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The primary objective of this work is to apply phase-field modeling in a knowledge based multi-scale simulation approach for the ferroelectric polycrystalline ceramics lead titanate and lead zirconate titanate (PZT) in order to bridge the gap between predictive atomistic and micromechanical modeling methods. Two interfaces in the multi-scale simulation chain are developed and established. Results of atomistic calculations are employed as input parameters for a phase-field model connecting the atomic level to the meso-scale. A novel and completely knowledge based adjustment method is developed ...