Abstract
A high-pressure (up to 4.95 GPa) single-crystal XRD study is carried out of the natural zeolite-like heteroframework zirconosilicate elpidite |Na1,65Ca0,15(H2O)3| [ZrSi6O15], sp. gr. Pbcm, a = 7.13201(19) Å, b = 14.6787(4) Å, c = 14.6297(3) Å, V = 1531.56(7) Å3, Z = 4. At pressures above 1.2 GPa, the elpidite undergoes a phase transition with the doubling of the a parameter of the unit cell (sp. gr. Pbca). The transition is caused by the opposite rotation of the originally equivalent Zr octahedra. Above 3.5 GPa, another phase transition is detected, this time with the symmetry being reduced to monoclinic (sp. gr. C1121/a). The framework deformation leads to a partial reorientation of H bonds in the extra-framework subsystem and a change in the configuration of Na and H2O chain from a unilaterally branched pattern to a bilaterally branched one.
Similar content being viewed by others
References
E. Cannillo, G. Rossi, and L. Ungaretti, Amer. Mineral., 58, 106 (1973).
A. A. Grigor’eva, N. V. Zubkova, I. V. Pekov, et al., Kristallografiya, 56, 890 (2011).
E. Fois, A. Gamba, G. Tabacchi, et al., Amer. Mineral., 90, 28 (2005).
G. D. Gatta, Eur. J. Mineral., 17, 411 (2005).
G. M. Sheldrick, Acta Crystallogr., A64, 112 (2008).
R. Boehler, Rev. Sci. Instrum., 77, art. No. 115103 (2006).
S. V. Rashchenko, A. Y. Likhacheva, and T. B. Bekker, High Press. Res., 33, 720–724 (2013).
A. Budzianowski and A. Katrusiak, in: High-Pressure Crystallography, A. Katrusiak and P. F. McMillan (eds.), Kluwer Academic Publishers, Dordrecht (2004), pp. 101–112.
R. J. Angel, J. Appl. Crystallogr., 37, 486 (2004).
N. V. Zubkova, D. A. Ksenofontov, Yu. K. Kabalov, et al., Norganicheskie Materialy, 47, 575–581 (2011).
Author information
Authors and Affiliations
Corresponding author
Additional information
Original Russian Text © 2014 Yu. V. Seryotkin, V. V. Bakakin, I. V. Pekov.
__________
Translated from Zhurnal Strukturnoi Khimii, Vol. 55, Supplement 1, pp. S69–S76, 2014.
Rights and permissions
About this article
Cite this article
Seryotkin, Y.V., Bakakin, V.V. & Pekov, I.V. Structural evolution of microporous zirconosilicate elpidite under high pressure. J Struct Chem 55, 1252–1259 (2014). https://doi.org/10.1134/S0022476614070087
Received:
Published:
Issue Date:
DOI: https://doi.org/10.1134/S0022476614070087