Frenkel, M.
, Diky, V.
, Chirico, R.
, Goldberg, R.
, Heerklotz, H.
, Ladbury, J.
, Remeta, D.
, Dymond, J.
, Goodwin, A.
, Marsh, K.
, Wakeham, W.
, Stein, S.
, Brown, P.
, Koenigsberger, E.
and Williams, P.
(2011),
ThermoML an XML-based Approach for Storage and Exchange of Experimental and Critically Evaluated Thermophysical and Thermochemical Property Data. 5. Speciation and Complex Equilibria, Journal of Chemical Information and Modeling, [online], https://tsapps.nist.gov/publication/get_pdf.cfm?pub_id=906899 (Accessed May 11, 2026)
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ThermoML an XML-based Approach for Storage and Exchange of Experimental and Critically Evaluated Thermophysical and Thermochemical Property Data. 5. Speciation and Complex Equilibria
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Author(s)
, , , , Heiko Heerklotz, John E. Ladbury, David P. Remeta, John H. Dymond, Anthony R. Goodwin, Kenneth N. Marsh, William A. Wakeham, , Paul L. Brown, Erich Koenigsberger, Peter A. Williams
Abstract
ThermoML is an XML-based approach for storage and exchange of experimental and critically evaluated thermophysical and thermochemical property data. Extensions to the ThermoML schema for the representation of speciation and complex equilibria are described. The text of ThermoML (xml) is provided to illustrate application of the new extensions. These are provided as Supporting Information together with the complete updated ThermoML schema.Citation
Journal of Chemical Information and Modeling
Pub Type
Journals
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Keywords
thermodynamics, data communications
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Created January 7, 2011, Updated May 7, 2026