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Phase stability, elastic behavior, and pressure-induced structural evolution of kalsilite: A ceramic material and high-T/high-P mineral
-
G. Diego Gatta
,
Ross J. Angel
Published/Copyright:
April 2, 2015
Abstract
The phase stability, elastic behavior, and pressure-induced structural evolution of a natural metamorphic kalsilite (ideal formula KAlSiO4) from Punalur (Kerala district in southern India), with P31c symmetry and a K/Na molar ratio of ~350, has been investigated by in situ X‑ray single-crystal diffraction up to ~7 GPa with a diamond-anvil cell under hydrostatic conditions. At high-pressure, a previously unreported iso-symmetric first-order phase transition occurs at ~3.5 GPa. The volume compression of the two phases is described by third-order Birch-Murnaghan equations-of-state: V0 = 201.02(1) Å3, KT0 = 59.7(5) GPa, K′ = 3.5(3) for the low-P polymorph, and V0 = 200.1(13) Å3, KT0 = 44(8) GPa, K′ = 6.4(20) for the high-P polymorph. The pressure-induced structural evolution in kalsilite up to 7 GPa appears to be completely reversible. The compression of both phases involves tetrahedral rotations around [0001], which close up the channels within the framework. In addition, compression of the low-pressure phase involves tilting of the tetrahedra. The major structural change at the phase transition is an increase in the tilting of the tetrahedra, but with a reversion of the tetrahedral rotations to the value found at ambient conditions. This behavior is in distinct contrast to that of nepheline, which has a tetrahedral framework of the same topology.
Keywords : Crystal structure; kalsilite; XRD data; single crystal; high pressure; compressibility; structural evolution; compressibility measurements
Received: 2011-1-22
Accepted: 2011-5-3
Published Online: 2015-4-2
Published in Print: 2011-8-1
© 2015 by Walter de Gruyter Berlin/Boston
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Keywords for this article
Crystal structure;
kalsilite;
XRD data;
single crystal;
high pressure;
compressibility;
structural evolution;
compressibility measurements
Articles in the same Issue
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