Estimation of the Heat Capacities of Organic Liquids as a Function of Temperature using Group Additivity. I. Hydrocarbon Compounds

Autor:	Eugene S. Domalski, Vlastimil Růžička
Rok vydání:	1993
Předmět:	Alkane chemistry.chemical_classification General Physics and Astronomy Thermodynamics General Chemistry Function (mathematics) Heat capacity Boiling point Hydrocarbon chemistry Group (periodic table) Additive function Range (statistics) Organic chemistry Physical and Theoretical Chemistry
Zdroj:	Journal of Physical and Chemical Reference Data. 22:597-618
ISSN:	1529-7845 0047-2689
Popis:	A second‐order group additivity method has been developed for the estimation of the heat capacity of liquid hydrocarbons as a function of temperature in the range from the melting temperature to the normal boiling temperature. The temperature dependence of group contributions and structural corrections has been represented by a polynomial expression. The adjustable parameters in the polynomials have been calculated using a weighted least squares minimization procedure. Recommended heat capacities from a large compilation of critically evaluated data that contains over 1300 organic liquids served as a database both for the development and testing of the method.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::a36b6e7e5b00e33594ad7a1fe92747fa https://doi.org/10.1063/1.555923 Zobrazit plný text záznamu