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Title: Flexibility of the zeolite RHO framework. In situ X-ray and neutron powder structural characterization of divalent cation-exchanged zeolite RHO

Journal Article · · Journal of the American Chemical Society; (USA)
DOI:https://doi.org/10.1021/ja00168a029· OSTI ID:6619947
; ;  [1]; ; ;  [2];  [3]
  1. E. I. du Pont de Nemours and Company, Inc., Wilmington, DE (USA)
  2. Univ. of California, Santa Barbara (USA)
  3. Brookhaven National Laboratory, Upton, NY (USA)

Zeolite RHO has an unusual three-dimensional monolayer surface with a topology that gives equal access to either side of the surface. In the absence of supporting structural subunits, e.g., smaller cages or channels, RHO exhibits atypical framework flexibility with large displacive rearrangements. These have been investigated by in situ X-ray powder diffraction studies of zeolite RHO exchanged with various divalent cations. The unit cell variation (e.g., Ca,H-RHO (400{degree}C), a = 13.970 (5) {angstrom}; Sr-RHO (250{degree}C), a = 14.045 (1) {angstrom}; Ba-RHO (200{degree}C), a = 14.184 (2) {angstrom}; Cd-RHO (350{degree}C), a = 14.488 (3) {angstrom}; Na,Cs-RHO (25{degree}C), a = 15.031 (1) {angstrom}) is a particularly sensitive function of cation and temperature. Rietveld analysis of neutron diffraction data was used to refine the structures of two samples, Ca,ND{sub 4}-RHO and Ca,D-RHO. Ca,D-RHO shows the largest reported deviation from Im{bar 3}m symmetry (a = 13.9645 (7) {angstrom}) for a RHO structure.

DOE Contract Number:
AC02-76CH00016
OSTI ID:
6619947
Journal Information:
Journal of the American Chemical Society; (USA), Vol. 112:12; ISSN 0002-7863
Country of Publication:
United States
Language:
English