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arxiv: cond-mat/0110431 · v1 · submitted 2001-10-20 · ❄️ cond-mat.str-el

Symmetry consideration and eg bands in NdNiO3 and YNiO3

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keywords magneticndnio3ynio3caseelectronicstructuresanalysesapplied
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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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