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Modelling noncollinear spin structure in YNiO3 perovskite: A GGA+U APW approach

Journal of Physics: Conference Series (2011) 289(1)
DOI: 10.1088/1742-6596/289/1/012002
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Abstract

In this work we compute the magnetic spin structure of the YNiO3 perovskite using the noncollinear APW implementation of WIEN2K. We compare LDA+U, GGA+U results to experimental results and find an improvement in comparison to previous theoretical work supposing an antiferromagnetic collinear alignment of the magnetic momenta.

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APA

Szwaja, M., & Calvayrac, F. (2011). Modelling noncollinear spin structure in YNiO3 perovskite: A GGA+U APW approach. In Journal of Physics: Conference Series (Vol. 289). Institute of Physics Publishing. https://doi.org/10.1088/1742-6596/289/1/012002

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