Comparison of CP-PC-SAFT and PC-SAFT with k 12 = 0 and PPR78 in Predicting Binary Systems of Hydrocarbons with Squalane, n‑dodecylbenzene, cis-decalin, Tetralin, and Naphthalene at High Pressures

This study compares accuracies of PC-SAFT and its critical point-based revision (CP-PC-SAFT) with k 12 = 0 along with the predictive 1978 Peng–Robinson EoS (PPR78) in estimating the available high-pressure phase equilibria data in binary systems of methane, ethylene, ethane, propane, and n-hexane wi...

Ausführliche Beschreibung

Gespeichert in:
Bibliographische Detailangaben
Veröffentlicht in:Industrial & engineering chemistry research 2021-11, Vol.60 (43), p.15805-15816
Hauptverfasser: Chiko, Asaf, Polishuk, Ilya
Format: Artikel
Sprache:eng
Schlagworte:
Online-Zugang:Volltext
Tags: Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
Beschreibung
Zusammenfassung:This study compares accuracies of PC-SAFT and its critical point-based revision (CP-PC-SAFT) with k 12 = 0 along with the predictive 1978 Peng–Robinson EoS (PPR78) in estimating the available high-pressure phase equilibria data in binary systems of methane, ethylene, ethane, propane, and n-hexane with heavy branched, alkylbenzoic, bicyclic aliphatic and aromatic substances represented by squalane, n-dodecylbenzene, cis-decalin, tetralin, and naphthalene. Predictions of the pure compound properties of the considered heavy substances are evaluated as well. It is found that some data were predicted more accurately by CP-PC-SAFT and othersby Peng–Robinson EoS and PPR78. At the same time, the overall performance of PC-SAFT in predicting these data is found inferior in comparison with two other considered approaches.
ISSN:0888-5885
1520-5045
DOI:10.1021/acs.iecr.1c03486