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Enabling simulations of grains within a full rotation range in amplitude expansion of the phase-field crystal model

Authors :
Matjaž Berčič
Goran Kugler
Source :
Physical review. E. 101(4-1)
Publication Year :
2018

Abstract

This paper introduces improvements to the amplitude expansion of the phase-field crystal model that enable the simulation of grains within a full range of orientations. The unphysical grain boundary between grains, rotated by a crystal's symmetry rotation, is removed using a combination of the auxiliary rotation field described in our previous work and an algorithm that correctly matches the complex amplitudes according to the differences in local rotation.

Details

ISSN :
24700053
Volume :
101
Issue :
4-1
Database :
OpenAIRE
Journal :
Physical review. E
Accession number :
edsair.doi.dedup.....f46ac354dc49cfb64a75d576eb9eaa84