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Fig. 1 | Advanced Modeling and Simulation in Engineering Sciences

Fig. 1

From: Microstructure evolution in deformed polycrystals predicted by a diffuse interface Cosserat approach

Fig. 1

Top: grain boundary energy as a function of misorientation for copper, obtained from atomistic calculations [50,51,52]. Bottom: result from calibration of model parameters for the orientation phase-field model (black stars) to fit the calculated grain boundary energy of a \(<100>\) tilt grain boundary from [50] (solid blue line). Only angles up to 30\(^\circ \) are considered in the calibration because the model does not capture the cusps seen in the full range of misorientation angles

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