journal article·2023-09-29Open access

Real Fluid Modeling and Simulation of the Structures and Dynamics of Condensation in CO2 Flows Shocked Inside a de Laval Nozzle, Considering the Effects of Impurities

Harshit Bhatia, Chaouki Habchi

Applied Sciences· Volume 13· Issue 19

Abstract

Because of the currently changing climate, Carbon Capture and Storage (CCS) is increasingly becoming an important contemporary topic. However, this technique still faces various challenges. For the compression of CO2 to its supercritical condition for efficient transport, one of the important challenges is mastering the two-phase flow in the pump. Indeed, phase changes that appear on the blade tips of an impeller or rotor in such pumps can lead to performance and stability issues. Moreover, these phase change phenomena (vaporization and condensation) can be significantly modified by the presence of impurities (N2, O2, H2S, etc.) whose nature depends on the source of the CO2 production. In this work, we focus on analyzing the high pressure flow behavior of CO2 mixed with varying levels of impurities in a de Laval nozzle, for which experimental results are available. Numerical simulations are performed using a real-fluid model (RFM) implemented in the CONVERGE CFD solver. In this model, a tabulation approach is used to provide the thermodynamic and transport properties of the mixture of CO2 with the impurities. The study is carried out with different inlet conditions, and the results are in good agreement with the available experimental data. In addition, the results provide insights on the interaction of the shock wave with the observed condensation phenomenon, as well as its impact on the amount of condensation and other thermodynamic variables. The research indicates that the presence of impurities mixed with CO2 significantly affects the observed condensation in gas streams, which is a crucial factor that cannot be overlooked when implementing CCS systems.
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Research context

OpenAlex topics: Combustion and flame dynamics · Combustion and Detonation Processes · Gas Dynamics and Kinetic Theory

SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.

Affiliations

IFP Energies Nouvelles, Institut Carnot Transports Energies, 1 et 4 Avenue de Bois-Préau, 92852 Rueil-Malmaison, France

References (43)

Show source-provided references
1. (2023, July 04). The Intergovernmental Panel on Climate Change (IPCC) Is the United Nations Body for Assessing the Science Related to Climate Change. Available online: https://www.ipcc.ch/.
2. Mesoporous MgO promoted with NaNO3/NaNO2 for rapid and high-capacity CO2 capture at moderate temperatures10.1016/j.cej.2017.09.068 ↗
3. Effect of impurities on thermophysical properties and phase behaviour of a CO2-rich system in CCS10.1016/j.ijggc.2013.08.019 ↗
4. Role of Impurities on CO2 Injection: Experimental and Numerical Simulations of Thermodynamic Properties of Water-salt-gas Mixtures (CO2 + Co-injected Gases) Under Geological Storage Conditions10.1016/j.egypro.2013.06.257 ↗
5. Dynamis CO2 quality recommendations10.1016/j.ijggc.2008.04.006 ↗
6. Thermodynamic interpolation for the simulation of two-phase flow of non-ideal mixtures10.1016/j.compchemeng.2016.09.005 ↗
7. The influence of impurities on the transportation safety of an anthropogenic CO2 pipeline10.1016/j.psep.2013.10.007 ↗
8. Brinckman, K.W., Hosangadi, A., Liu, Z., and Weathers, T. (2018). Turbo Expo Power for Land, Sea and Air, Proceedings of the ASME Turbo Expo 2018: Turbomachinery Technical Conference and Exposition, Oslo, Norway, 11–15 June 2018, American Society of Mechanical Engineers. Volume 9: Oil and Gas Applications; Supercritical CO2 Power Cycles; Wind Energy.
9. An Investigation of Real Gas Effects in Supercritical CO2 Centrifugal Compressors10.1115/1.4029616 ↗
10. An Investigation of Condensation Effects in Supercritical Carbon Dioxide Compressors10.1115/1.4029577 ↗
11. Characterization of Nonequilibrium Condensation of Supercritical Carbon Dioxide in a de Laval Nozzle10.1115/1.4038082 ↗
12. Computational fluid-dynamic modelling of two-phase compressible flows of carbon dioxide in supercritical conditions10.1016/j.applthermaleng.2021.116816 ↗
13. Supersonic two-phase flow of CO2 through converging–diverging nozzles for the ejector refrigeration cycle10.1016/j.ijrefrig.2009.01.015 ↗
14. Validation of a Three-Dimensional Internal Nozzle Flow Model Including Automatic Mesh Generation and Cavitation Effects10.1115/1.4027193 ↗
15. Crossing the Widom-line—Supercritical pseudo-boiling10.1016/j.supflu.2014.12.019 ↗
16. Jafari, S., Gaballa, H., Habchi, C., and de Hemptinne, J.C. (2021). Towards Understanding the Structure of Subcritical and Transcritical Liquid–Gas Interfaces Using a Tabulated Real Fluid Modeling Approach. Energies, 14.10.3390/en14185621 ↗
17. Transport of CO2: Presentation of New Thermophysical Property Measurements and Phase Diagrams10.1016/j.egypro.2017.03.1822 ↗
18. Volume of fluid (VOF) method for the dynamics of free boundaries10.1016/0021-9991(81)90145-5 ↗
19. Level Set Methods: An Overview and Some Recent Results10.1006/jcph.2000.6636 ↗
20. A two-phase mixture theory for the deflagration-to-detonation transition (ddt) in reactive granular materials10.1016/0301-9322(86)90033-9 ↗
21. Diffuse-Interface Capturing Methods for Compressible Two-Phase Flows10.1146/annurev-fluid-122316-050109 ↗
22. Free Energy of a Nonuniform System. I. Interfacial Free Energy10.1063/1.1744102 ↗
23. Linstrom, P. (2023). NIST Chemistry WebBook, NIST Standard Reference Database 69, NIST.
24. Modeling and LES of high-pressure liquid injection under evaporating and non-evaporating conditions by a real fluid model and surface density approach10.1016/j.ijmultiphaseflow.2022.104372 ↗
25. Gaballa, H., Jafari, S., Di-Lella, A., Habchi, C., and de Hemptinne, J.C. (September, January 30). A tabulated real-fluid modeling approach applied to renewable dual-fuel evaporation and mixing. Proceedings of the International Conference on Liquid Atomization and Spray Systems (ICLASS), Edinburgh, UK.
26. Numerical investigation of droplet evaporation in high-pressure dual-fuel conditions using a tabulated real-fluid model10.1016/j.ijheatmasstransfer.2022.122671 ↗
27. The CPA EoS application to model CO2 and H2S simultaneous solubility in ionic liquid [C2mim][PF6]10.1080/10916466.2018.1454953 ↗
28. Real-fluid phase transition in cavitation modeling considering dissolved non-condensable gas10.1063/1.5140981 ↗
29. A multicomponent real-fluid fully compressible four-equation model for two-phase flow with phase change10.1063/1.5065781 ↗
30. Homogeneous two-phase flow models and accurate steam-water table look-up method for fast transient simulations10.1016/j.ijmultiphaseflow.2017.06.001 ↗
31. On the use of tabulated equations of state for multi-phase simulations in the homogeneous equilibrium limit10.1007/s00193-019-00896-1 ↗
32. Real-fluid injection modeling and LES simulation of the ECN Spray A injector using a fully compressible two-phase flow approach10.1016/j.ijmultiphaseflow.2019.103145 ↗
33. Richards, K.J., Senecal, P.K., and Pomraning, E. (2023). CONVERGE 3.1, Convergent Science.
34. A New Two-Constant Equation of State10.1021/i160057a011 ↗
35. Equilibrium constants from a modified Redlich-Kwong equation of state10.1016/0009-2509(72)80096-4 ↗
36. A consistent correction for Redlich-Kwong-Soave volumes10.1016/0378-3812(82)80002-2 ↗
37. On the thermodynamics of solutions; an equation of state; fugacities of gaseous solutions10.1021/cr60137a013 ↗
38. Ten Years with the CPA (Cubic-Plus-Association) Equation of State. Part 1. Pure Compounds and Self-Associating Systems10.1021/ie051305v ↗
39. Mutual solubilities of hydrocarbons and water with the CPA EoS10.1016/j.fluid.2007.05.023 ↗
40. Re-evaluating the CPA EoS for improving critical points and derivative properties description10.1016/j.fluid.2017.01.002 ↗
41. Exploring the interaction between phase separation and turbulent fluid dynamics in multi-species supercritical jets using a tabulated real-fluid model10.1016/j.supflu.2022.105557 ↗
42. Two-equation eddy-viscosity turbulence models for engineering applications10.2514/3.12149 ↗
43. Gaballa, H., Jafari, S., Di-Lella, A., Habchi, C., and de Hemptinne, J.C. (September, January 30). A tabulated real-fluid modeling approach applied to cryogenic LN2-H2 jets evaporation and mixing at transcritical regime. Proceedings of the International Conference on Liquid Atomization and Spray Systems (ICLASS), Edinburgh, UK.