About: Anti-Polarity in Ideal BiMnO3

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Attributs	Valeurs
type	work Article
Is Part Of	http://hub.abes.fr/acs/periodical/jacsat/2007/volume_129/issue_32/w
Subject	Communication
Title	Anti-Polarity in Ideal BiMnO3
has manifestation of work	http://hub.abes.fr/acs/periodical/jacsat/2007/volume_129/issue_32/101021ja073415u/m/web http://hub.abes.fr/acs/periodical/jacsat/2007/volume_129/issue_32/101021ja073415u/m/print
related by	http://hub.abes.fr/acs/periodical/jacsat/2007/volume_129/issue_32/101021ja073415u/authorship/1 http://hub.abes.fr/acs/periodical/jacsat/2007/volume_129/issue_32/101021ja073415u/authorship/2 http://hub.abes.fr/acs/periodical/jacsat/2007/volume_129/issue_32/101021ja073415u/authorship/3
Author	Spaldin Nicola A. Seshadri R. Baettig Pio
Abstract	The structure and properties of the possible multiferroic, BiMnO3, are calculated using the LDA+U method of density functional theory. The symmetry is found to be centrosymmetric C2/c with zero ferroelectric polarization. The stereochemically active Bi lone pairs form local dipole moments which order in an anti-polar arrangement.
article type	rapid-communication
is part of this journal	Journal of the American Chemical Society

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