Incommensurately modulated structure of Zn4Si2O7(OH)2·H2O at high pressure

Bibliographic Details
Title: Incommensurately modulated structure of Zn4Si2O7(OH)2·H2O at high pressure
Authors: Roman Gajda, Wojciech Sławiński, Tomasz Poręba, Jan Parafiniuk, Mohamed Mezouar, Przemysław Dera, Krzysztof Woźniak
Source: IUCrJ, Vol 12, Iss 1, Pp 62-73 (2025)
Publisher Information: International Union of Crystallography, 2025.
Publication Year: 2025
Collection: LCC:Crystallography
Subject Terms: high-pressure phase transitions, modulation, incommensurate structures, hemimorphite, diamond anvil cells, Crystallography, QD901-999
More Details: High-resolution single-crystal X-ray diffraction experiments on Zn4Si2O7(OH)2·H2O hemimorphite were conducted at high pressure using diamond anvil cells at several different synchrotron facilities (ESRF, Elettra, DESY). Experimental data confirmed the existence of a previously reported phase transition and revealed the exact nature of the incommensurate modulation. We report the incommensurately modulated structure described in the (3+1)D space group Pnn2(0, β, 0)000. We have determined the modulation mechanism, which involves the fluctuation of atoms between two main positions, occurring mainly along the [100] direction, perpendicular to the modulation vector. Moreover, our results reveal that the phase transition occurs at lower pressure than previously reported.
Document Type: article
File Description: electronic resource
Language: English
ISSN: 2052-2525
20522525
Relation: https://journals.iucr.org/paper?S2052252524011060; https://doaj.org/toc/2052-2525
DOI: 10.1107/S2052252524011060
Access URL: https://doaj.org/article/e7a73eb997cc4276be3f128bd551491d
Accession Number: edsdoj.7a73eb997cc4276be3f128bd551491d
Database: Directory of Open Access Journals
More Details
ISSN:20522525
DOI:10.1107/S2052252524011060
Published in:IUCrJ
Language:English