Neutron scattering from local magnetoelectric multipoles: A combined theoretical, computational, and experimental perspective

We address magnetic neutron scattering in the presence of local noncentrosymmetric asymmetries of the magnetization density. Such inversion-symmetry breaking, combined with the absence of time-reversal symmetry, can be described in terms of magnetoelectric multipoles which form the second term after...

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Bibliographic Details
Main Authors: Andrea Urru, Jian-Rui Soh, Navid Qureshi, Anne Stunault, Bertrand Roessli, Henrik M. Rønnow, Nicola A. Spaldin
Format: Article
Language:English
Published: American Physical Society 2023-09-01
Series:Physical Review Research
Online Access:http://doi.org/10.1103/PhysRevResearch.5.033147
Description
Summary:We address magnetic neutron scattering in the presence of local noncentrosymmetric asymmetries of the magnetization density. Such inversion-symmetry breaking, combined with the absence of time-reversal symmetry, can be described in terms of magnetoelectric multipoles which form the second term after the magnetic dipole in the multipole expansion of the magnetization density. We provide a pedagogical review of the theoretical formalism of magnetic neutron diffraction in terms of the multipole expansion of the scattering cross-section. In particular, we show how to compute the contribution of magnetoelectric multipoles to the scattering amplitude starting from ab initio calculations. We also provide general guidelines on how to experimentally detect long-range order of magnetoelectric multipoles using either unpolarized or polarized neutron scattering. We apply the formalism to CuO, and we discuss first-principles predictions and experimental spherical neutron polarimetry measurements that are consistent with the presence of magnetoelectric multipoles in CuO.
ISSN:2643-1564