Determination of the magnetization distribution in Cr2O3 using spherical neutron polarimetry

Maximum-entropy reconstruction of the magnetization densityThe density corresponds to the difference between the observed magnetization distribution and that calculated from the multipole model.

Determination of the magnetization distribution in Cr2O3 using spherical neutron polarimetry

The magnetization distribution in the antiferromagnet Cr₂O₃ (where the nuclear and magnetic scattering appear in the same reflections and are in phase quadrature) has been determined with good precision using spherical neutron polarimetry.

The determined total moment associated with each Cr³⁺ ion is only 2.48 μB rather than the predicted 2.97 μB. The loss of moment can be attributed to covalent mixing of the Cr 3d electrons with O 2p orbitals in π-type antibonding orbitals.

Positive and negative spin transferred to O from oppositely polarized Cr³⁺ ions is superposed and so does not contribute to the magnetization. There are some significant features in the magnetization distribution (see fig.) which are not accounted for by the ionic model. They occur in regions where the Cr and O radial wavefunctions overlap strongly and are hence probably due to covalent overlap.

Ref.: P. J. Brown, J. B. Forsyth, E. Lelièvre-Berna and F. Tasset , J. Phys.: Condens. Matter 14 (2002) 1957–1966.