Open Access to the JESS Chemical Reaction Database
Peter M. May, Montserrat Filella
Abstract
Abstract The JESS (Joint Expert Speciation System) Thermodynamic Database (v8.9) is now available as a set of freely available PDF files. This reaction database contains about 280,000 thermodynamic parameters (equilibrium constants, enthalpies, etc.) as published in the literature for over 80,000 chemical reactions. It is grounded in the tradition of the Stability Constants Special Publications (by the Chemical Society) but it has become much more extensive and it includes some quantitative indication of parameter reliability based mainly on intra- and extra-reaction consistency.
Topics & Concepts
ChemistryConsistency (knowledge bases)Chemical stabilityChemical reactionDatabaseThermodynamicsStability (learning theory)Equilibrium constantPhysical chemistryComputer scienceOrganic chemistryArtificial intelligencePhysicsMachine learningAdvanced Chemical Physics StudiesZeolite Catalysis and SynthesisCatalysis and Oxidation Reactions