Database of thermodynamic properties for aqueous organic compounds

N. V. Plyasunova, A. V. Plyasunov, Everett Shock

Research output: Contribution to journalArticle

42 Scopus citations

Abstract

Results are presented from a project undertaken to develop a database for properties of organic compounds relevant for geochemistry and environmental chemistry. The database includes critically assessed standard thermodynamic properties in aqueous solution, properties of pure compounds at ambient conditions, and bibliographic references. All information stored in the databases is accessible through a web interface, which includes calculation modules for evaluating properties at elevated temperatures and pressures. The basic structure of the databases and the web interface design are described.

Original languageEnglish (US)
Pages (from-to)351-360
Number of pages10
JournalInternational Journal of Thermophysics
Volume25
Issue number2
DOIs
StatePublished - Mar 1 2004

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Keywords

  • Aqueous solutions
  • Data compilation
  • Database
  • Organic compounds
  • Pure compounds
  • Thermodynamic properties
  • Thermodynamic properties of hydration

ASJC Scopus subject areas

  • Condensed Matter Physics

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