Symmetry consideration and eg bands in NdNiO3 and YNiO3

Details Symmetry consideration and eg bands in NdNiO3 and YNiO3 Symmetry consideration and eg bands in NdNiO3 and YNiO3

2001-10-20

arxiv.org/abs/cond-mat/0110431v1

J. Phys. Chem. Solids, 63, 1347-1351 (2002)

Physics

Condensed Matter

Strongly Correlated Electrons

6 pages, 3 figures, Proc. Int. Symp. ISSP-Kashiwa 2001

Scientific paper

10.1016/S0022-3697(02)00085-9

Group theoretical analyses are applied to the magnetic and electronic structures of NdNiO3 and YNiO3, whose electronic structures have been studied very recently by the LSDA+U method. The Jahn-Teller distortion cannot satisfy the experimentally observed magnetic diffraction. The resultant ground state magnetic stuructures are monoclinic P_ba in NdNiO3 case and P_b2_1/a in YNiO3 case, respectively.

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