Optimization and performance evaluation of equations of state for supercritical CO2-rich mixtures for application in the NET Power cycle

In this paper the interaction parameters of six equations of state (EoS) were calibrated from density and phase equilibrium experimental data of supercritical CO 2 -rich mixtures. The Peng-Robinson (PR), Soave-Redlich-Kwong (SRK), Lee-Kesler-Plöcker (LKP), Benedict-Webb-Rubin-Starling (BWRS), perturbed chain SAFT (PC-SAFT) and Cubic-Plus-Association (CPA) EoSs were considered. As a novelty, the pressure, temperature and composition ranges for calibration were (1 – 49) MPa, (293.18 – 423.15) K, and (72.6 – 99.8) % mol CO 2 , which are close to those found in the innovative oxy-combustion NET Power cycle, particularizing the optimization of the EoSs for application in this power cycle. The performance of the EoSs, including the GERG-2008 EoS, was assessed in an isentropic compression process from 7.4 MPa to 30 MPa. The LKP EoS reported the lowest average deviation, 2.03 %, in modeling the bubble and dew lines of the supercritical CO 2 – H 2 O mixture. The GERG-2008 EoS was the most reliable model capturing the density of the supercritical CO 2 -rich mixtures, reporting an average deviation of 1.34 %. Therefore, the combination GERG-2008 + LKP is recommended for NET Power cycle modeling purposes. Only the CPA and GERG-2008 models captured the liquid-like properties of the CO 2 -rich mixture during the compression. This resulted in a specific compression work of 33.02 kJ kg −1 for GERG-2008, while the PR, SRK, LKP, and PC-SAFT EoSs reported a value up to 1.54, 1.65, 1.53, and 1.70 times higher. • Equations of state were optimized for application in the novel NET Power cycle. • LKP EoS captured the CO 2 - H 2 O bubble and dew lines with the lowest error, 2.03 %. • GERG-2008 captured the density of the sCO 2 mixtures with the lowest error, 1.34 %. • The GERG-2008 specific work was 32.91 kJ kg −1 , up to 1.71 lower than other EoSs.

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Publication Details

Journal
The Journal of Supercritical Fluids
Published
2025-06-11
DOI
https://doi.org/10.1016/j.supflu.2025.106693
Citations
6
Primary Topic
Phase Equilibria and Thermodynamics
Type
article
Field-Weighted Citation Impact
4.04

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article

Optimization and performance evaluation of equations of state for supercritical CO2-rich mixtures for application in the NET Power cycle

M. Reyes, Frederiek Demeyer, Iván Velázquez
6 citations
The Journal of Supercritical Fluids
Phase Equilibria and Thermodynamics
4.04
article

Optimization and performance evaluation of equations of state for supercritical CO2-rich mixtures for application in the NET Power cycle

M. Reyes, Frederiek Demeyer, Iván Velázquez
article en
6 citations

Abstract

In this paper the interaction parameters of six equations of state (EoS) were calibrated from density and phase equilibrium experimental data of supercritical CO 2 -rich mixtures. The Peng-Robinson (PR), Soave-Redlich-Kwong (SRK), Lee-Kesler-Plöcker (LKP), Benedict-Webb-Rubin-Starling (BWRS), perturbed chain SAFT (PC-SAFT) and Cubic-Plus-Association (CPA) EoSs were considered. As a novelty, the pressure, temperature and composition ranges for calibration were (1 – 49) MPa, (293.18 – 423.15) K, and (72.6 – 99.8) % mol CO 2 , which are close to those found in the innovative oxy-combustion NET Power cycle, particularizing the optimization of the EoSs for application in this power cycle. The performance of the EoSs, including the GERG-2008 EoS, was assessed in an isentropic compression process from 7.4 MPa to 30 MPa. The LKP EoS reported the lowest average deviation, 2.03 %, in modeling the bubble and dew lines of the supercritical CO 2 – H 2 O mixture. The GERG-2008 EoS was the most reliable model capturing the density of the supercritical CO 2 -rich mixtures, reporting an average deviation of 1.34 %. Therefore, the combination GERG-2008 + LKP is recommended for NET Power cycle modeling purposes. Only the CPA and GERG-2008 models captured the liquid-like properties of the CO 2 -rich mixture during the compression. This resulted in a specific compression work of 33.02 kJ kg −1 for GERG-2008, while the PR, SRK, LKP, and PC-SAFT EoSs reported a value up to 1.54, 1.65, 1.53, and 1.70 times higher. • Equations of state were optimized for application in the novel NET Power cycle. • LKP EoS captured the CO 2 - H 2 O bubble and dew lines with the lowest error, 2.03 %. • GERG-2008 captured the density of the sCO 2 mixtures with the lowest error, 1.34 %. • The GERG-2008 specific work was 32.91 kJ kg −1 , up to 1.71 lower than other EoSs.

The Journal of Supercritical FluidsVol. 225
Universidad de Valladolid (ES), Engie (Belgium) (BE)
Universidad de Valladolid
Affordable and clean energy
Openalex Percentile: Top 6%
Phase Equilibria and Thermodynamics
4.04
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