Publication Date:
2012-07-31
Description:
Author(s): X. F. Hao, A. Stroppa, S. Picozzi, A. Filippetti, and C. Franchini We present a study based on several advanced first-principles methods of the recently synthesized PbNiO 3 [ J. Am. Chem. Soc. 133 16920 (2011) ], a rhombohedral antiferromagnetic insulator, which crystallizes in the highly distorted R 3 c crystal structure. We find this compound electrically polarized ... [Phys. Rev. B 86, 014116] Published Mon Jul 30, 2012
Keywords:
Structure, structural phase transitions, mechanical properties, defects
Print ISSN:
1098-0121
Electronic ISSN:
1095-3795
Topics:
Physics
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