Lattice defects in fcc Ni from ab initio perspective

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Authors	MAZALOVÁ Martina PAVLŮ Jana VŠIANSKÁ Monika ŠOB Mojmír
Year of publication	2018
Type	Conference abstract
MU Faculty or unit	Faculty of Science
Citation	MAZALOVÁ, Martina; Jana PAVLŮ; Monika VŠIANSKÁ and Mojmír ŠOB. Lattice defects in fcc Ni from ab initio perspective. In PISACMS2018: Paris International School on Advanced Computational Materials Science. 2018.
Description	We present a detailed theoretical study of lattice defects (Al and Si impurities, vacancies and the sigma 5(210) grain boundaries (GB)) in ferromagnetic fcc Ni focusing mainly on the analysis of structure arrangement, the stability of various configurations and the influence of defects on magnetism.
Related projects:	CERIT Scientific Cloud CEITEC 2020