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Evidence of interspersed co-existing CaCO3-III and CaCO3-IIIb structures in polycrystalline CaCO3 at high pressure

Published online by Cambridge University Press:  05 July 2018

M. Merlini ,
W. A. Crichton ,
J. Chantel ,
J. Guignard  and
S. Poli
M. Merlini*
Affiliation:
Dipartimento di Scienze della Terra, Università degli Studi di Milano, Via Botticelli, 23, 20133 Milano, Italy
W. A. Crichton
Affiliation:
ESRF, European Synchrotron Radiation Facility, 6 rue Jules Horowitz, 38043 Grenoble cedex, France Department of Earth Sciences, University College London, Gower Street, London WC1E 6BT, UK
J. Chantel
Affiliation:
ESRF, European Synchrotron Radiation Facility, 6 rue Jules Horowitz, 38043 Grenoble cedex, France
J. Guignard
Affiliation:
ESRF, European Synchrotron Radiation Facility, 6 rue Jules Horowitz, 38043 Grenoble cedex, France
S. Poli
Affiliation:
Dipartimento di Scienze della Terra, Università degli Studi di Milano, Via Botticelli, 23, 20133 Milano, Italy
*
E-mail: [email protected]
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Abstract

New experimental data are reported on high-pressure polymorphism of CaCO3. The CaCO3-III phase was stabilized using a large-volume press device and high-resolution X-ray powder diffraction (XRPD) patterns were collected from a few mm3 of powder sample. The interpretation of XRPD indicates that CaCO3-III and CaCO3-IIIb structures are present simultaneously and are in similar proportions. The lack of any unindexed peaks demonstrates that these two polymorphs are the only phases in this experiment, indicating that CaCO3-III and CaCO3-IIIb are the structures most likely to occur above 2.5 GPa. Relevant co-axial crystallographic matrix transformations from lower-pressure polymorphs to both CaCO3-III and CaCO3-IIIb are discussed to illustrate a further possible occurrence of co-existing and interspersed stable polymorphs in carbonate systems.

Keywords

CaCO3polycrystallinehigh pressure
Type
Research Article
Information
Mineralogical Magazine , Volume 78 , Issue 2 , April 2014 , pp. 225 - 233
Copyright
Copyright © The Mineralogical Society of Great Britain and Ireland 2014

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Footnotes

Current address: Laboratoire Magmas et Volcans, Université Blaise Pascal - OPGC − CNRS, 5, Rue Kessler, 63038 Clermont-Ferrand Cedex, France

References

Arapan, S., De Almeida, J.S. and Ahuia, R. (2007) Formation of sp(3) hybridized bonds and stability of CaCO3 at very high pressure. Physical Review Letters, 98, 268501.CrossRefGoogle Scholar
Biellmann, C., Gillet, P., Guyot, F., Peyronneau, J. and Reynard, B. (1993) Experimental evidence for carbonate stability in the Earth’s lower mantle. Earth and Planetary Science Letters, 118, 31–41.CrossRefGoogle Scholar
Bridgman, P.W. (1939) The high pressure behavior of miscellaneous minerals. American Journal of Science, 237, 7–18.CrossRefGoogle Scholar
Catalli, K. and Williams, Q. (2005) A high-pressure phase transition of calcite-III. American Mineralogist, 90, 1679–1682.CrossRefGoogle Scholar
Colonna, F., Fasolino, A. and Meijer, E.J. (2011) Highpressure high-temperature equation of state of graphite from Monte Carlo simulations. Carbon, 49, 364–368.CrossRefGoogle Scholar
Dal Negro, A. and Ungaretti, L. (1971) Refinement of the crystal structure of aragonite. American Mineralogist, 56, 768–772.Google Scholar
Davis, B.L. (1964) X-ray diffraction data on two highpressure phases of calcium carbonate. Science, 145, 489–491.CrossRefGoogle Scholar
Dewaele, A., Fiquet, G., Andrault, D. and Hausermann, D. (2000) P-V-T equation of state of periclase from synchrotron radiation measurements. Journal of Geophysical Research, 105, 2869–2877.CrossRefGoogle Scholar
Fiquet, G., Guyot, F. and Itie, J.-P. (1994) High-pressure X-ray diffraction study of carbonates: MgCO3, CaMg(CO3)2, and CaCO3 . American Mineralogist, 79, 15–23.Google Scholar
Hagiya, K., Matsui, M., Kimura, Y. and Akahama, Y. (2005) The crystal data and stability of calcite III at high pressures based on single-crystal X-ray experiments. Journal of Mineralogical and Petrological Sciences, 100, 31–36.CrossRefGoogle Scholar
Hanfland, M., Syassen, K. and Sonnenschein, R. (1989) Graphite under pressure – Equation of state and 1st-order Raman modes. Physical Review B, 40, 1951–1954.CrossRefGoogle Scholar
Hazen, R.M. (1976) Effects of temperature and pressure on the cell dimension and X-ray temperature factors of periclase. American Mineralogist, 61, 266–271.Google Scholar
Kabalah-Amitai, L., Mayzel, B., Kauffmann, Y., Fitch, A.N., Bloch, L., Gilbert, P.U.P.A. and Pokroy, B. (2013) Vaterite crystals contain two interspersed crystal structures. Science, 340, 454–457.CrossRefGoogle ScholarPubMed
Larson, A.C. and Von Dreele, R.B. (1994) General Structure Analysis System (GSAS). Los Alamos National Laboratory Report LAUR 86-748. Los Alamos National Laboratory, New Mexico, USA.Google Scholar
Liu, L.-G. and Mernagh, T.P. (1990) Phase transitions and Raman spectra of calcite at high pressures and room temperature. American Mineralogist, 75, 801–806.Google Scholar
Mao, Z., Armentrout, M., Rainey, E., Manning, C.E., Dera, P., Prakapenka, V.B. and Kavner, A. (2011) Dolomite III: A new candidate lower mantle carbonate. Geophysical Research Letters, 38, L22303.Google Scholar
Martinez, I., Zhang, J. and Reeder, R.J. (1996) In situ X-ray diffraction of aragonite and dolomite at high pressure and high temperature: Evidence for dolomite breakdown to aragonite and magnesite. American Mineralogist, 81, 611–624.CrossRefGoogle Scholar
Maslen, E.N., Streltsov, V.A. and Streltsova, N.R. (1993) X-ray study of the electron density in calcite, CaCO3, Acta Crystallographica B, 49, 636–641.CrossRefGoogle Scholar
Merlini, M. and Hanfland, M. (2013) Single crystal diffraction at Mbar conditions by synchrotron radiation. High Pressure Research, 33, 511–522. http://dx.doi.org/10.1080/08957959.201 CrossRefGoogle Scholar
Merlini, M., Crichton, W., Hanfland, M., Gemmi, M., Müller, H. Kupenko, I. and Dubrovinsky, L. (2012a) Structures of dolomite at ultrahigh pressure and their influence on the deep carbon cycle, Proceedings of the National Academy of Sciences of the U.S.A., 109, 13509–13514.CrossRefGoogle Scholar
Merlini, M., Hanfland, M. and Crichton, W. (2012b) CaCO3-III and CaCO3-VI, high-pressure polymorphs of calcite: possible host structures for carbon in the Earth’s mantle. Earth and Planetary Science Letters, 333, 265–271.CrossRefGoogle Scholar
Merrill, L. and Bassett, W.A. (1975) The crystal structure of CaCO3(II), a high-pressure metastable phase of calcium carbonate. Acta Crystallographica B, 31, 343–349.CrossRefGoogle Scholar
Nicol, M. and Ellenson, W.D. (1972) Raman spectrum of CaCO3(III) at 77K. Journal of Chemical Physics, 56, 677–679.CrossRefGoogle Scholar
Oganov, A.R., Glass, C.W. and Ono, S. (2006) Highpressure phases of CaCO3: crystal structure prediction and experiment. Earth and Planetary Science Letters, 241, 95–103.CrossRefGoogle Scholar
Oganov, A.R., Ono, S., Ma, Y.M., Glass, C.W. and Garcia, A. (2008) Novel high-pressure structures of MgCO3, CaCO3 and CO2 and their role in Earth’s lower mantle. Earth and Planetary Science Letters, 273, 38–47.CrossRefGoogle Scholar
Oganov, A.R., Hemley, R.J., Hazen, R.M. and Jones, A.P. (2013) Structure, bonding, and mineralogy of carbon at extreme conditions. Pp. 47–77 in: Carbon in Earth (R.M. Hazen, A.P. Jones and J.A. Baross, editors). Reviews in Mineralogy and Geochemistry, 75. Mineralogical Society of America and The Geochemical Society, Washington, D.C. Google Scholar
Redfern, S.A.T. (2000) Structural variations in carbonates. Pp. 289–308 in: High-Temperature and High- Pressure Crystal Chemistry (R.M. Hazen and R.T. Downs, editors). Reviews in Mineralogy and Geochemistry, 41. Mineralogical Society of America and The Geochemical Society, Washington, D.C.Google Scholar
Smyth, J.R. and Ahrens, T.J. (1997) The crystal structure of calcite III. Geophysical Research Letters, 24, 1595–1598.CrossRefGoogle Scholar
Suito, K., Namba, J., Horikawa, T., Taniguchi, Y., Sakurai, N., Kobayashi, M., Onodera, A., Shimomura, O. and Kikegawa, T. (2001) Phase relations of CaCO3 at high pressure and high temperature. American Mineralogist, 86, 997–1002.CrossRefGoogle Scholar
Tyburczy, J.T. and Ahrens, T.J. (1986) Dynamic compression and volatile release of carbonates. Journal of Geophysical Research, 91, 4730–4744.CrossRefGoogle Scholar
Williams, Q., Collerson, B. and Knittle, E. (1992) Vibrational spectra of magnesite (MgCO3) and calcite-III at high pressures. American Mineralogist, 77, 1158–1165.Google Scholar