Group contribution multifluid lattice theory for simultaneous predictions of thermodynamic properties of pure fluids and mixtures

Autor:	Eun Hyun Choi, Hun Yong Shin, Chul Lee, Ki-Pung Yoo
Rok vydání:	1999
Předmět:	Alkane chemistry.chemical_classification Equation of state Chemistry Phase equilibrium General Chemical Engineering General Physics and Astronomy Thermodynamics Interaction energy Group contribution method Lattice fluid Lattice (order) Binary system Physical and Theoretical Chemistry
Zdroj:	Fluid Phase Equilibria. 161:257-264
ISSN:	0378-3812
DOI:	10.1016/s0378-3812(99)00189-2
Popis:	A unified group contribution (GC) lattice equation of state (EOS) was formulated based on the multifluid approximation of the nonrandom lattice fluid theory. The GC-EOS requires segment size and interaction energy parameter from functional group characteristics. The unique feature of the approach is that a single set of group parameters are used for both pure fluids and mixtures. The approach was found to be quantitatively applicable for predicting thermodynamic properties of real pure fluids and mixtures. Its potential utility was demonstrated for vapor pressures, vapor–liquid coexistence densities of pure fluids and phase equilibrium properties of mixtures including polymeric solutions.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::8fec9b395d53e323920563ac9627c49d https://doi.org/10.1016/s0378-3812(99)00189-2 Zobrazit plný text záznamu Full Text from ScienceDirect