Abstract
The standard thermodynamic potentials of natural zeolites in universal stoichiometric representation are computed. The enthalpies are estimated using linear deconvolution into chemical elements for calibration minerals. The entropies are computed using the additive scheme for oxide components; the Gibbs free energies are computed based on the calculated standard thermodynamic functions and entropies of thermochemically simple compounds.
Similar content being viewed by others
References
V. V. Bakakin and Yu. V. Seretkin, Zh. Strukt. Khim. 50, 123 (2009).
A. La Iglesia and A. J. Aznar, Appl. Spectr. 6, 26 (1986).
R. Mathieu and Ph. Vieillard, Micropor. Mesopor. Mater 132, 335 (2010).
A. Navrotsky and Z. R. Tian, Chem.-Eur. J. 7, 769 (2001).
A. A. Godovikov, Mineralogy (Nedra, Moscow, 1975) [in Russian].
L. Wu, A. Navrotsky, Y. Lee, et al., Micropor. Mesopor. Mater. 167, 221 (2013).
P. Blanc, P. Vieillard, H. Gailhanou, et al., Appl. Geochem. 55, 95 (2015).
O. V. Eremin, O. S. Rusal’, V. A. Bychinskii, et al., Russ. J. Inorg. Chem. 60, 950 (2015).
O. V. Yeriomin, Int. J. Geosci. 3, 227 (2011).
O. V. Eremin, Geokhimiya, No. 9, 859 (2014).
L. P. Ogorodova, L. V. Melchakova, and L. A. Kiseleva, Geochem. Int, 9, 996 (2009).
L. P. Ogorodova, L. V. Mel’chakova, and I. A. Kiseleva, Russ. J. Phys. Chem. A 82, 138 (2008).
N. Petrova, Compt. Rend. Acad. Bulg. Sci. 50, 69 (1997).
E. S. Epova, O. V. Eremin, R. A. Filenko, et al., Khim. Interesah Ustoich. Razvit., No. 21, 207 (2013).
L. Mercury, Ph. Vieillard, and Y. Tardy, Appl. Geochem. 16, 161 (2001).
K. V. Chudnenko, Thermodynamic Modeling in Geochemistry: Theory, Algorithms, Software, Applications (GEO, Novosibirsk, 2010) [in Russian].
H. Yokokawa, J. Nat. Chem. Lab. Ind. Tsukuba Ibaraki 305 (Jpn.) 83, 27 (1988).
I. A. Kiseleva and L. P. Ogorodova, The Thermochemistry of Minerals and Inorganic Materials (Nauchnyi Mir, Moscow, 1997) [in Russian].
G. K. Johnson, I. R. Tasker, R. Jurgens, et al., J. Chem. Thermodyn. 23, 475 (1991).
L. V. Mel’chakova, L. P. Ogorodova, I. A. Kiseleva, et al., Russ. J. Phys. Chem. A 78, 2037 (2004).
L. P. Ogorodova and I. A. Kiseleva, and L. V. Mel’chakova, Russ. J. Phys. Chem. A 81, 315 (2007).
L. P. Ogorodova, L. V. Mel’chakova, I. A. Kiseleva, et al., Geokhimiya, No. 7, 793 (2005).
L. P. Ogorodova, L. V. Melchakova, and I. A. Kiseleva, Russ. J. Phys. Chem. A 81, 1748 (2007).
S. Yang, A. Navrotsky, and R. Wilkin, Am. Mineral. 86, 438 (2001).
T. L. Wood and R. M. Garrels, Thermodynamic Values at Low Temperature for Natural Inorganic Materials (Oxford Univ. Press, Oxford, 1987).
Ch.Baerlocher, L.B.McCusker, and D.H.Olson, http://www.iza-structure.org/databases/books/Atlas_6ed. pdf.
Author information
Authors and Affiliations
Corresponding author
Additional information
Original Russian Text © O.V. Eremin, E.S. Epova, O.S. Rusal’, R.A. Filenko, V.A. Bychinskii, K.V. Chudnenko, S.V. Fomichev, V.A. Krenev, 2016, published in Zhurnal Neorganicheskoi Khimii, 2016, Vol. 61, No. 8, pp. 1053–1062.
Rights and permissions
About this article
Cite this article
Eremin, O.V., Epova, E.S., Rusal’, O.S. et al. The unified method for computing thermodynamic properties of natural zeolites based on their crystallochemical formulas. Russ. J. Inorg. Chem. 61, 1003–1012 (2016). https://doi.org/10.1134/S0036023616080064
Received:
Published:
Issue Date:
DOI: https://doi.org/10.1134/S0036023616080064