Temperature dependence of the structural parameters in the transformation of aragonite to calcite, as determined from in situ synchrotron powder X-ray-diffraction data

Canadian Mineralogist

Volumn 48, Issue 5, 2010, Pages 1225-1236

  Antao, Sytle M ^a   Hassan, Ishmael ^b  

^a UNIVERSITY OF CALGARY   (Canada)

^b UNIVERSITY OF THE WEST INDIES   (Jamaica)

Author keywords

Aragonite; CaCO3; Calcite; High temperature structure; Phase transition; Rietveld refinement; X ray diffraction

Indexed keywords

AMBIENT PRESSURES; ARAGONITE; CACO3; DIFFRACTION DATA; FIRST ORDER TRANSITIONS; HIGH-TEMPERATURE IN SITU; HIGH-TEMPERATURE STRUCTURE; IN-SITU SYNCHROTRONS; POLYMORPHIC TRANSITIONS; RIETVELD; RIETVELD STRUCTURE REFINEMENT; SPACE GROUPS; STRUCTURAL PARAMETER; TEMPERATURE DEPENDENCE; TEMPERATURE DEPENDENCIES;

CALCITE; CRYSTAL STRUCTURE; DIFFRACTION; METADATA; PHASE TRANSITIONS; RIETVELD METHOD; RIETVELD REFINEMENT; SYNCHROTRONS; X RAY DIFFRACTION; X RAYS;

CARBONATE MINERALS;

ARAGONITE; CALCITE; CALCIUM CARBONATE; HIGH TEMPERATURE; PHOSPHORUS; TEMPERATURE EFFECT; TRANSFORMATION; X-RAY DIFFRACTION;

EID: 78650910597     PISSN: 00084476     EISSN: None     Source Type: Journal    
DOI: 10.3749/canmin.48.5.1225     Document Type: Article

References (32)

1. 3: linear structural trends. Can. Mineral. 47, 1245-1255.
2. 3. Phys. Chem. Minerais 35, 545-557.
3. ANTAO, S.M., HASSAN, I., MULDER, W.H., LEE, P.L. & TOBY, B.H. (2009): In situ study of the R3̄c-→ R3̄m orientational disorder in calcite. Phys. Chem. Minerais 36, 159-169.
4. 2 and its influence on the aragonite + magnesite → dolomite reaction boundary. Am. Mineral. 89, 1142-1147.
5. BERG, G.W. (1986): Evidence for carbonate in the mantle. Nature 324, 50-51.
6. BEVAN, D.J.M., ROSSMANITH, E., MYLREA, D.K., NESS, S.E., TAYLOR, M.R. & CUFF, C. (2002): On the structure of aragonite - Lawrence Bragg revisited. Acta Crystallogr. B58, 448-456.
7. BRAGG, W.L. (1924): The structure of aragonite. Proc. R. Soc. London A105, 16-37.
8. 3 and the aragonite-calcite transformation. In Carbonates: Mineralogy and Chemistry (R.J. Reeder, ed.). Rev. Mineral. 11, 191-225.
9. CASPI, E.N., POKROY, B., LEE, P.L., QUINTANA, J.P. & ZOLOTOYABKO, E. (2005): On the structure of aragonite. Acta Crystallogr. B61, 129-132.
10. DAL NEGRO, A. & UNGARETTI, L. (1971): Refinement of crystal structure of aragonite. Am. Mineral. 56, 768-772.
11. DE VILLIERS, J.P.R. (1971): Crystal structures of aragonite, strontianite, and witherite. Am. Mineral. 56, 758-767.
12. 3. J. Res. Nat. Bureau Stand. A75, 27-32.
13. GILLET, P., BIELLMANN, C., REYNARD, B. & MCMILLAN, P. (1993): Raman spectroscopic studies of carbonates. I. High-pressure and high-temperature behaviour of calcite, magnesite, dolomite and aragonite. Phys. Chem. Minerals 20, 1-18.
14. HAMMERSLEY, A.P., SVENSSON, S.O., HANFLAND, M., FITCH, A.N. & HAUSERMANN, D. (1996): Two-dimensional detector software: from real detector to idealised image to twotheta scan. High Pressure Res. 14, 235-248.
15. 3II. Phys. Chem. Minerals 27, 467-473.
16. JAROSCH, D. & HEGER, G. (1986): Neutron diffraction refinement of the crystal structure of aragonite. Tschermaks Mineral. Petrogr. Mitt. 35, 127-131.
17. JOHANNES, W. & PUHAN, D. (1971): The calcite-aragonite transition, reinvestigated. Contrib. Mineral. Petrol. 31, 28-38.
18. LARSON, A.C. & VON DREELE, R.B. (2000): General Structure Analysis System (GSAS). Los Alamos National Lab., Rep. LAUR 86-748.
19. LIN, C.C. & LIU, L.G. (1997): High pressure phase transformations in aragonite-type carbonates. Phys. Chem. Minerals 24, 149-157.
20. LIU, M. & YUND, R.A. (1993): Transformation kinetics of polycrystalline aragonite to calcite: new experimental data, modelling, and implications. Contrib. Mineral. Petrol. 114, 465-478.
21. LUCAS, A., MOUALLEM-BAHOUT, M., CAREL, C., GAUDÉ, J. & MATECKI, M. (1999): Thermal expansion of synthetic aragonite condensed review of elastic properties. J. Solid State Chem. 146, 73-78.
22. 3. Phys. Chem. Minerals 34, 215-221.
23. POKROY, B., FIERAMOSCA, J.S., VON DREELE, R.B., FITCH, A.N., CASPI, E.N. & ZOLOTOYABKO, E. (2007): Atomic structure of biogenic aragonite. Chem. Materials 19, 3244-3251.
24. REDFERN, S.A.T., SALJE, E. & NAVROTSKY, A. (1989): Hightemperature enthalpy at the orientational order-disorder transition in calcite - implications for the calcite-aragonite phase-equilibrium. Contrib. Mineral. Petrol. 101, 479-484.
25. REEDER, R.J., ed. (1983): Carbonates: Mineralogy and Chemistry. Rev. Mineral. 11.
26. RIETVELD, H.M. (1969): A profile refinement method for nuclear and magnetic structures. Appl. Crystallogr. 2, 65-71.
27. SALJE, E. & VISWANATHAN, K. (1976): Phase-diagram calcite-aragonite as derived from crystallographic properties. Contrib. Mineral. Petrol. 55, 55-67.
28. 3. Am. Mineral. 89, 1348-1352.
29. SHENG XUEFEN, CHEN JUN, CAI YUANFENG, CHEN YANG & JI JUNFENG (2005): Aragonite-calcite transformation in fossil snail shells of loess sequence in Loess Plateau, central China. Chinese Sci. Bull. 50, 891-895.
30. TOBY, B.H. (2001): EXPGUI, a graphical user interface for GSAS. J. Appl. Crystallogr. 34, 210-213.
31. WARDECKI, D., PRZENIOSLO, R. & BRUNELLI, M. (2008): Internal pressure in annealed biogenic aragonite. Crystal Eng. Comm. 10, 1450-1453.
32. WYCKOFF, R.W.G. (1925): Orthorhombic space group criteria and their applications to aragonite. Am. J. Sci. 209, 145-175.