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100 1 _ |a Timoshenko, Janis
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245 _ _ |a Local structure of nanosized tungstates revealed by evolutionary algorithm
260 _ _ |a Weinheim
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520 _ _ |a Nanostructured tungstates, such as CoWO$_{4}$ and CuWO$_{4}$, are very promising catalytic materials, particularly for photocatalytic oxidation of water. The high catalytic activity of tungstate nanoparticles partially is a result of their extremely small sizes, and, consequently, high surface-to-volume ratio. Therefore their properties depend strongly on the atomic structure, which differ significantly from that of the bulk material. X-ray absorption spectroscopy is a powerful technique to address the challenging problem of the local structure determination in nanomaterials. In order to fully exploit the structural information contained in X-ray absorption spectra, in this study we employ a novel evolutionary algorithm (EA) for the interpretation of the Co and Cu K-edges as well as the W L$_{3}$-edge extended X-ray absorption fine structure (EXAFS) of nanosized CoWO$_{4}$ and CuWO$_{4}$. The combined EA-EXAFS approach and simultaneous analysis of the W L$_{3}$ and Co(Cu) K-edge EXAFS spectra allowed us for the first time to obtain a 3D structure model of the tungstate nanoparticles and to explore in details the effect of size, temperature and transition metal type.
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700 1 _ |a Anspoks, Andris
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700 1 _ |a Kuzmin, Alexei
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773 _ _ |a 10.1002/pssa.201431561
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