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Provisional Recommendations

Committee on Printed and Electronic Publications

Extension of ThermoML: The IUPAC Standard for Thermodynamic Data Communications

Prepared by Michael Frenkel, Robert D. Chirico, Vladimir Diky, Paul L. Brown, John H. Dymond, Robert. N. Goldberg, Anthony R. H. Goodwin, Heiko Heerklotz, Erich Königsberger, John E. Ladbury, Kenneth N. Marsh, David P. Remeta, Stephen E. Stein, William A. Wakeham, and Peter A. Williams

ThermoML is an XML-based approach for storage and exchange of experimental, predicted, and critically evaluated thermophysical and thermochemical property data. Extensions to the ThermoML schema for the representation of speciation, complex equilibria, and properties of biomaterials are described. The texts of fourteen data files illustrating the new extensions are provided as Supporting Information together with the complete text of the updated ThermoML schema.

> Download full text of the Provisional Recommendations (pdf file - 5.62MB; 278 pages!)

Comments by 31 August 2011
To: Dr. Michael Frenkel
National Institute of Standards & Technology
Physical and Chemical Properties Division, 838
Boulder, CO 80305-3328
E-mail: [email protected]

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