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Modeling solubility of CO(2)–N(2) gas mixtures in aqueous electrolyte systems using artificial intelligence techniques and equations of state

Determining the solubility of non-hydrocarbon gases such as carbon dioxide (CO(2)) and nitrogen (N(2)) in water and brine is one of the most controversial challenges in the oil and chemical industries. Although many researches have been conducted on solubility of gases in brine and water, very few r...

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Autores principales: Nakhaei-Kohani, Reza, Taslimi-Renani, Ehsan, Hadavimoghaddam, Fahime, Mohammadi, Mohammad-Reza, Hemmati-Sarapardeh, Abdolhossein
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8901744/
https://www.ncbi.nlm.nih.gov/pubmed/35256623
http://dx.doi.org/10.1038/s41598-022-07393-z
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author Nakhaei-Kohani, Reza
Taslimi-Renani, Ehsan
Hadavimoghaddam, Fahime
Mohammadi, Mohammad-Reza
Hemmati-Sarapardeh, Abdolhossein
author_facet Nakhaei-Kohani, Reza
Taslimi-Renani, Ehsan
Hadavimoghaddam, Fahime
Mohammadi, Mohammad-Reza
Hemmati-Sarapardeh, Abdolhossein
author_sort Nakhaei-Kohani, Reza
collection PubMed
description Determining the solubility of non-hydrocarbon gases such as carbon dioxide (CO(2)) and nitrogen (N(2)) in water and brine is one of the most controversial challenges in the oil and chemical industries. Although many researches have been conducted on solubility of gases in brine and water, very few researches investigated the solubility of power plant flue gases (CO(2)–N(2) mixtures) in aqueous solutions. In this study, using six intelligent models, including Random Forest, Decision Tree (DT), Gradient Boosting-Decision Tree (GB-DT), Adaptive Boosting-Decision Tree (AdaBoost-DT), Adaptive Boosting-Support Vector Regression (AdaBoost-SVR), and Gradient Boosting-Support Vector Regression (GB-SVR), the solubility of CO(2)–N(2) mixtures in water and brine solutions was predicted, and the results were compared with four equations of state (EOSs), including Peng–Robinson (PR), Soave–Redlich–Kwong (SRK), Valderrama–Patel–Teja (VPT), and Perturbed-Chain Statistical Associating Fluid Theory (PC-SAFT). The results indicate that the Random Forest model with an average absolute percent relative error (AAPRE) value of 2.8% has the best predictions. The GB-SVR and DT models also have good precision with AAPRE values of 6.43% and 7.41%, respectively. For solubility of CO(2) present in gaseous mixtures in aqueous systems, the PC-SAFT model, and for solubility of N(2), the VPT EOS had the best results among the EOSs. Also, the sensitivity analysis of input parameters showed that increasing the mole percent of CO(2) in gaseous phase, temperature, pressure, and decreasing the ionic strength increase the solubility of CO(2)–N(2) mixture in water and brine solutions. Another significant issue is that increasing the salinity of brine also has a subtractive effect on the solubility of CO(2)–N(2) mixture. Finally, the Leverage method proved that the actual data are of excellent quality and the Random Forest approach is quite reliable for determining the solubility of the CO(2)–N(2) gas mixtures in aqueous systems.
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spelling pubmed-89017442022-03-08 Modeling solubility of CO(2)–N(2) gas mixtures in aqueous electrolyte systems using artificial intelligence techniques and equations of state Nakhaei-Kohani, Reza Taslimi-Renani, Ehsan Hadavimoghaddam, Fahime Mohammadi, Mohammad-Reza Hemmati-Sarapardeh, Abdolhossein Sci Rep Article Determining the solubility of non-hydrocarbon gases such as carbon dioxide (CO(2)) and nitrogen (N(2)) in water and brine is one of the most controversial challenges in the oil and chemical industries. Although many researches have been conducted on solubility of gases in brine and water, very few researches investigated the solubility of power plant flue gases (CO(2)–N(2) mixtures) in aqueous solutions. In this study, using six intelligent models, including Random Forest, Decision Tree (DT), Gradient Boosting-Decision Tree (GB-DT), Adaptive Boosting-Decision Tree (AdaBoost-DT), Adaptive Boosting-Support Vector Regression (AdaBoost-SVR), and Gradient Boosting-Support Vector Regression (GB-SVR), the solubility of CO(2)–N(2) mixtures in water and brine solutions was predicted, and the results were compared with four equations of state (EOSs), including Peng–Robinson (PR), Soave–Redlich–Kwong (SRK), Valderrama–Patel–Teja (VPT), and Perturbed-Chain Statistical Associating Fluid Theory (PC-SAFT). The results indicate that the Random Forest model with an average absolute percent relative error (AAPRE) value of 2.8% has the best predictions. The GB-SVR and DT models also have good precision with AAPRE values of 6.43% and 7.41%, respectively. For solubility of CO(2) present in gaseous mixtures in aqueous systems, the PC-SAFT model, and for solubility of N(2), the VPT EOS had the best results among the EOSs. Also, the sensitivity analysis of input parameters showed that increasing the mole percent of CO(2) in gaseous phase, temperature, pressure, and decreasing the ionic strength increase the solubility of CO(2)–N(2) mixture in water and brine solutions. Another significant issue is that increasing the salinity of brine also has a subtractive effect on the solubility of CO(2)–N(2) mixture. Finally, the Leverage method proved that the actual data are of excellent quality and the Random Forest approach is quite reliable for determining the solubility of the CO(2)–N(2) gas mixtures in aqueous systems. Nature Publishing Group UK 2022-03-07 /pmc/articles/PMC8901744/ /pubmed/35256623 http://dx.doi.org/10.1038/s41598-022-07393-z Text en © The Author(s) 2022 https://creativecommons.org/licenses/by/4.0/Open Access This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article's Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article's Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/ (https://creativecommons.org/licenses/by/4.0/) .
spellingShingle Article
Nakhaei-Kohani, Reza
Taslimi-Renani, Ehsan
Hadavimoghaddam, Fahime
Mohammadi, Mohammad-Reza
Hemmati-Sarapardeh, Abdolhossein
Modeling solubility of CO(2)–N(2) gas mixtures in aqueous electrolyte systems using artificial intelligence techniques and equations of state
title Modeling solubility of CO(2)–N(2) gas mixtures in aqueous electrolyte systems using artificial intelligence techniques and equations of state
title_full Modeling solubility of CO(2)–N(2) gas mixtures in aqueous electrolyte systems using artificial intelligence techniques and equations of state
title_fullStr Modeling solubility of CO(2)–N(2) gas mixtures in aqueous electrolyte systems using artificial intelligence techniques and equations of state
title_full_unstemmed Modeling solubility of CO(2)–N(2) gas mixtures in aqueous electrolyte systems using artificial intelligence techniques and equations of state
title_short Modeling solubility of CO(2)–N(2) gas mixtures in aqueous electrolyte systems using artificial intelligence techniques and equations of state
title_sort modeling solubility of co(2)–n(2) gas mixtures in aqueous electrolyte systems using artificial intelligence techniques and equations of state
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8901744/
https://www.ncbi.nlm.nih.gov/pubmed/35256623
http://dx.doi.org/10.1038/s41598-022-07393-z
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