期刊
GLASS PHYSICS AND CHEMISTRY
卷 36, 期 6, 页码 663-672出版社
PLEIADES PUBLISHING INC
DOI: 10.1134/S1087659610060040
关键词
cluster analysis; tiling method; nanoclusters; zeolites; paulingite; RHO; ISC-1
资金
- Presidium of the Russian Academy of Sciences
The cluster analysis and modeling of self-assembly of the crystal structures of zeolites, i.e., zeolite RHO, paulingite PAU, and hypothetical zeolite ISC-1 separated as a local structure in the paulingite framework, have been performed. It has been established using the tiling method that the RHO, PAU, and ISC-1 frameworks contain two, seven, and five topological types of cavities, which are occupied by extraframework cations and/or water molecules. The zeolite structures have been described as ensembles of nanoclusters that represent local regions of the tetrahedral T framework and uniquely determine the topological features of the framework. The structure of the synthesized paulingite-Na, K, TEA (where TEA is tetraethylammonium) has been analyzed using X-ray powder diffraction. The chemical formula of the ISC-1 zeolite in the form Na(14)K(24)Al(38)Si(202)O(480 center dot)nH(2)O has been proposed from the data on the composition and structure of paulingite (minerals and synthetic phases).
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