3D electron diffraction studies of synthetic rhabdophane (DyPO<sub>4</sub>·<i>n</i>H<sub>2</sub>O)

In this study, we report the results of continuous rotation electron diffraction studies of single DyPO<sub>4</sub>·nH<sub>2</sub>O (rhabdophane) nanocrystals. The diffraction patterns can be fit to a trigonal lattice (P3<sub>1</sub>21) with lattice parameters a = 7.019 (5) and c = 6.417 (5) Å. However, there is also a set of diffuse background scattering features present that are associated with a disordered superstructure that is double these lattice parameters and fits with an arrangement of water molecules present in the structure pore. Pair distribution function (PDF) maps based on the diffuse background allowed the extent of the water correlation to be estimated, with 2-3 nm correlation along the c axis and ∼5 nm along the a/b axis.

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Publication Details

Journal
Acta Crystallographica Section C Structural Chemistry
Published
2024-09-03
DOI
https://doi.org/10.1107/s2053229624007885
Citations
2
Primary Topic
Luminescence Properties of Advanced Materials
Type
article
Field-Weighted Citation Impact
0.23

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article

3D electron diffraction studies of synthetic rhabdophane (DyPO4·nH2O)

Alexander S. Eggeman, Anamul H. Mir, Simon A. Hunt, Mohamed Ruwaid Rafiuddin et al.
2 citations
Acta Crystallographica Section C Structural Chemistry
Luminescence Properties of Advanced Materials
0.23
article

3D electron diffraction studies of synthetic rhabdophane (DyPO4·nH2O)

Alexander S. Eggeman, Anamul H. Mir, Simon A. Hunt, Mohamed Ruwaid Rafiuddin, Ercin C. Duran, Yazhou Shen
article en
2 citations

Abstract

In this study, we report the results of continuous rotation electron diffraction studies of single DyPO<sub>4</sub>·nH<sub>2</sub>O (rhabdophane) nanocrystals. The diffraction patterns can be fit to a trigonal lattice (P3<sub>1</sub>21) with lattice parameters a = 7.019 (5) and c = 6.417 (5) Å. However, there is also a set of diffuse background scattering features present that are associated with a disordered superstructure that is double these lattice parameters and fits with an arrangement of water molecules present in the structure pore. Pair distribution function (PDF) maps based on the diffuse background allowed the extent of the water correlation to be estimated, with 2-3 nm correlation along the c axis and ∼5 nm along the a/b axis.

Acta Crystallographica Section C Structural ChemistryVol. 80(10)
University of Huddersfield (GB), University of Manchester (GB), Istanbul Technical University (TR)
Henry Royce Institute, Royal Society, Sight Research UK, Engineering and Physical Sciences Research Council, Natural Environment Research Council
Clean water and sanitation
Openalex Percentile: Top 52%
Luminescence Properties of Advanced Materials
0.23
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