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PUBLICATIONS

Windows-Based Guided Data Capture Software for Mass-Scale Thermophysical and Thermochemical Property Data Collection

Published

Author(s)

Vladimir Diky, Robert D. Chirico, R C. Wihoit, Qian Dong, Michael D. Frenkel

Abstract

Guided data-capture software (GDC) is described for mass-scale abstraction from the literature of experimental then-nophysical and thermochemical property data for organic chemical systems involving one, two and three components,chemical reactions, and chemical equilibria. Property values are captured using a strictly hierarchical system based upon rigorous application of the thermodynamic constraints of the Gibbs phase rule with full traceability to source documents. Kefeatures of the program and its adherence to scientific principles are described with particular emphasis on data quality issue both in terms of data accuracy and database integrity.
Citation
Journal of Chemical Information and Computer Sciences
Pub Type
Journals

Keywords

computer software, Gibbs Phase rule, thermodynamic data Collection

Citation

Diky, V. , Chirico, R. , Wihoit, R. , Dong, Q. and Frenkel, M. (2003), Windows-Based Guided Data Capture Software for Mass-Scale Thermophysical and Thermochemical Property Data Collection, Journal of Chemical Information and Computer Sciences (Accessed April 26, 2024)

Created February 1, 2003, Updated February 17, 2017