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Simulation of Crystal Structures for Cubic Bifluorids MR3F10

Authors: Golubev A.M., Dzyabchenko A.V., Podgursky S.V. Published: 01.09.2014
Published in issue: #2(7)/2001  
DOI:

 
Category: Chemistry  
Keywords:

Crystallochemical simulation of crystal structures for the cubic bifluorides KTb3F10 and RbEu3F10 with the use of clusters M8R6F68 is conducted. Starting-models for further refinements using computer are found on the basis of analysis of possible ways of joining the clusters within the crystal lattice. Good agreement is obtained between the calculated and experimental parameters of the structures under consideration.