<?xml version="1.0"?>
<!DOCTYPE rdf:RDF SYSTEM "http://dublincore.org/documents/2002/07/31/dcmes-xml/dcmes-xml-dtd.dtd" > 
<rdf:RDF xmlns:rdf="http://www.w3.org/1999/02/22-rdf-syntax-ns#" xmlns:dc="http://purl.org/dc/elements/1.1/">
 <rdf:Description>
  <dc:title>Chemical Thermodynamics and Activity Diagrams</dc:title>
  <dc:subject>CRAN Task View: ChemPhys (http://CRAN.R-project.org/view=ChemPhys)</dc:subject>
  <dc:description>This package includes functions and data sets to support
chemical thermodynamic modeling in biochemistry and
low-temperature geochemistry. The features include calculation
of the standard molal thermodynamic properties and chemical
affinities of reactions involving minerals and/or biomolecules;
a database of thermodynamic properties of aqueous, crystalline
and gaseous species; amino acid group additivity for the
standard molal thermodynamic properties of neutral and ionized
proteins; use of the revised Helgeson-Kirkham-Flowers equations
of state for aqueous species; construction of equilibrium
activity diagrams as a function of temperature, pressure, and
chemical activities or fugacities of basis species.</dc:description>
  <dc:type>Software</dc:type>
  <dc:relation>Depends: R (&gt;= 2.10.0), utils</dc:relation>
  <dc:relation>Suggests: xtable</dc:relation>
  <dc:creator>Jeffrey M. Dick &lt;jmdick@asu.edu&gt;</dc:creator>
  <dc:contributor>Jeffrey M. Dick &lt;jmdick@asu.edu&gt;</dc:contributor>
  <dc:rights>GPL (&gt;= 2)</dc:rights>
  <dc:date>2011-08-23</dc:date>
  <dc:format>application/tgz</dc:format>
  <dc:identifier>http://CRAN.R-project.org/package=CHNOSZ</dc:identifier>
 </rdf:Description>
</rdf:RDF>

