Articles with "dft simulations" as a keyword



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DFT simulations to clarify the molecular origin of magnetoelectric coupling in R3c materials based on Fe

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Published in 2019 at "New Journal of Chemistry"

DOI: 10.1039/c9nj02761k

Abstract: Multiferroic materials are characterized by the existence of ferroic properties coupled in a single crystalline phase and represent great promise for the development of spintronics devices. read more here.

Keywords: molecular origin; magnetoelectric coupling; origin magnetoelectric; clarify molecular ... See more keywords