Microscopic Description of the Ferroism in Lead-Free AlFeO3

The microscopic origin of the ferroic and multiferroic properties of AlFeO 3 have been carefully investigated. The maximum entropy method was applied to X-ray diffraction data and ab initio density functional theory calculations in order to obtain the electron density distributions and electric pola...

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Veröffentlicht in:	Scientific reports 2018-04, Vol.8 (1), p.1-8, Article 6420
Hauptverfasser:	Santos, Guilherme M., Catellani, Igor B., Santos, Ivair A., Guo, Ruyan, Bhalla, Amar S., Padilha, José Eduardo, Cótica, Luiz F.
Format:	Artikel
Sprache:	eng
Schlagworte:	119/118 639/301/1005/1007 639/301/119/996 Entropy Humanities and Social Sciences Maximum entropy Maximum entropy method multidisciplinary Polarization Science Science (multidisciplinary) X-ray diffraction
Online-Zugang:	Volltext
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