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Intelligent modeling of hydrogen sulfide solubility in various types of single and multicomponent solvents

This study aims to study the solubility of acid gas, i.e., hydrogen sulfide (H(2)S) in different solvents. Three intelligent approaches, including Multilayer Perceptron (MLP), Gaussian Process Regression (GPR) and Radial Basis Function (RBF) were used to construct reliable models based on an extensi...

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Autores principales: Moradkhani, M. A., Hosseini, S. H., Ranjbar, K., Moradi, M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9992357/
https://www.ncbi.nlm.nih.gov/pubmed/36882537
http://dx.doi.org/10.1038/s41598-023-30777-8
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author Moradkhani, M. A.
Hosseini, S. H.
Ranjbar, K.
Moradi, M.
author_facet Moradkhani, M. A.
Hosseini, S. H.
Ranjbar, K.
Moradi, M.
author_sort Moradkhani, M. A.
collection PubMed
description This study aims to study the solubility of acid gas, i.e., hydrogen sulfide (H(2)S) in different solvents. Three intelligent approaches, including Multilayer Perceptron (MLP), Gaussian Process Regression (GPR) and Radial Basis Function (RBF) were used to construct reliable models based on an extensive databank comprising 5148 measured samples from 54 published sources. The analyzed data cover 95 single and multicomponent solvents such as amines, ionic liquids, electrolytes, organics, etc., in broad pressure and temperature ranges. The proposed models require just three simple input variables, i.e., pressure, temperature and the equivalent molecular weight of solvent to determine the solubility. A competitive examination of the novel models implied that the GPR-based one gives the most appropriate estimations with excellent AARE, R(2) and RRMSE values of 4.73%, 99.75% and 4.83%, respectively for the tested data. The mentioned intelligent model also performed well in describing the physical behaviors of H(2)S solubility at various operating conditions. Furthermore, analyzing the William's plot for the GPR-based model affirmed the high reliability of the analyzed databank, as the outlying data points comprise just 2.04% of entire data. In contrast to the literature models, the newly presented approaches proved to be applicable for different types of single and multicomponent H(2)S absorbers with AAREs less than 7%. Eventually, a sensitivity analysis based on the GPR model reflected the fact that the solvent equivalent molecular weight is the most influential factor in controlling H(2)S solubility.
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spelling pubmed-99923572023-03-09 Intelligent modeling of hydrogen sulfide solubility in various types of single and multicomponent solvents Moradkhani, M. A. Hosseini, S. H. Ranjbar, K. Moradi, M. Sci Rep Article This study aims to study the solubility of acid gas, i.e., hydrogen sulfide (H(2)S) in different solvents. Three intelligent approaches, including Multilayer Perceptron (MLP), Gaussian Process Regression (GPR) and Radial Basis Function (RBF) were used to construct reliable models based on an extensive databank comprising 5148 measured samples from 54 published sources. The analyzed data cover 95 single and multicomponent solvents such as amines, ionic liquids, electrolytes, organics, etc., in broad pressure and temperature ranges. The proposed models require just three simple input variables, i.e., pressure, temperature and the equivalent molecular weight of solvent to determine the solubility. A competitive examination of the novel models implied that the GPR-based one gives the most appropriate estimations with excellent AARE, R(2) and RRMSE values of 4.73%, 99.75% and 4.83%, respectively for the tested data. The mentioned intelligent model also performed well in describing the physical behaviors of H(2)S solubility at various operating conditions. Furthermore, analyzing the William's plot for the GPR-based model affirmed the high reliability of the analyzed databank, as the outlying data points comprise just 2.04% of entire data. In contrast to the literature models, the newly presented approaches proved to be applicable for different types of single and multicomponent H(2)S absorbers with AAREs less than 7%. Eventually, a sensitivity analysis based on the GPR model reflected the fact that the solvent equivalent molecular weight is the most influential factor in controlling H(2)S solubility. Nature Publishing Group UK 2023-03-07 /pmc/articles/PMC9992357/ /pubmed/36882537 http://dx.doi.org/10.1038/s41598-023-30777-8 Text en © The Author(s) 2023 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
Moradkhani, M. A.
Hosseini, S. H.
Ranjbar, K.
Moradi, M.
Intelligent modeling of hydrogen sulfide solubility in various types of single and multicomponent solvents
title Intelligent modeling of hydrogen sulfide solubility in various types of single and multicomponent solvents
title_full Intelligent modeling of hydrogen sulfide solubility in various types of single and multicomponent solvents
title_fullStr Intelligent modeling of hydrogen sulfide solubility in various types of single and multicomponent solvents
title_full_unstemmed Intelligent modeling of hydrogen sulfide solubility in various types of single and multicomponent solvents
title_short Intelligent modeling of hydrogen sulfide solubility in various types of single and multicomponent solvents
title_sort intelligent modeling of hydrogen sulfide solubility in various types of single and multicomponent solvents
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9992357/
https://www.ncbi.nlm.nih.gov/pubmed/36882537
http://dx.doi.org/10.1038/s41598-023-30777-8
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