Abstract
This study compares accuracies of PC-SAFT and its critical point-based revision (CP-PC-SAFT) with k12 = 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.
| Original language | English |
|---|---|
| Pages (from-to) | 15805-15816 |
| Number of pages | 12 |
| Journal | Industrial and Engineering Chemistry Research |
| Volume | 60 |
| Issue number | 43 |
| DOIs | |
| State | Published - 3 Nov 2021 |
All Science Journal Classification (ASJC) codes
- General Chemistry
- General Chemical Engineering
- Industrial and Manufacturing Engineering