The incommensurately modulated structures of the perovskites NaCeMnWO6 and NaPrMnWO6.

Inorg Chem

Departamento de Química Inorgánica, Facultad de Ciencias Químicas, Universidad Complutense, Madrid 28040, Spain.

Published: April 2012

The structures of the doubly ordered perovskites NaCeMnWO(6) and NaPrMnWO(6), with rock salt ordering of the Mn(2+) and W(6+)B-site cations and layered ordering of the Na(+) and (Ce(3+)/Pr(3+)) A-site cations, have been studied by transmission electron microscopy, electron diffraction, neutron and synchrotron X-ray powder diffraction. Both compounds possess incommensurately modulated crystal structures. In NaCeMnWO(6) the modulation vector (with reference to the ideal ABX(3) perovskite subcell) is q ≈ 0.067a* (∼58.7 Å) and in NaPrMnWO(6)q ≈ 0.046a* (∼85.3 Å). In both compounds the superstructures are primarily the two-dimensional chessboard type, although some crystals of NaCeMnWO(6) were found with one-dimensional stripes. In some crystals of NaPrMnWO(6) there is a coexistence of chessboards and stripes. Modeling of neutron diffraction data shows that octahedral tilting plays an important role in the structural modulation.

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Source
http://dx.doi.org/10.1021/ic202071nDOI Listing

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