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Modeling porosity loss in Fe(0)-based permeable reactive barriers with Faraday’s law

Solid iron corrosion products (FeCPs), continuously generated from iron corrosion in Fe(0)-based permeable reactive barriers (PRB) at pH > 4.5, can lead to significant porosity loss and possibility of system’s failure. To avoid such failure and to estimate the long-term performance of PRBs, relia...

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Autores principales: Yang, Huichen, Hu, Rui, Ruppert, Hans, Noubactep, Chicgoua
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8379187/
https://www.ncbi.nlm.nih.gov/pubmed/34417542
http://dx.doi.org/10.1038/s41598-021-96599-8
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author Yang, Huichen
Hu, Rui
Ruppert, Hans
Noubactep, Chicgoua
author_facet Yang, Huichen
Hu, Rui
Ruppert, Hans
Noubactep, Chicgoua
author_sort Yang, Huichen
collection PubMed
description Solid iron corrosion products (FeCPs), continuously generated from iron corrosion in Fe(0)-based permeable reactive barriers (PRB) at pH > 4.5, can lead to significant porosity loss and possibility of system’s failure. To avoid such failure and to estimate the long-term performance of PRBs, reliable models are required. In this study, a mathematical model is presented to describe the porosity change of a hypothetical Fe(0)-based PRB through-flowed by deionized water. The porosity loss is solely caused by iron corrosion process. The new model is based on Faraday’s Law and considers the iron surface passivation. Experimental results from literature were used to calibrate the parameters of the model. The derived iron corrosion rates (2.60 mmol/(kg day), 2.07 mmol/(kg day) and 1.77 mmol/(kg day)) are significantly larger than the corrosion rate used in previous modeling studies (0.4 mmol/(kg day)). This suggests that the previous models have underestimated the impact of in-situ generated FeCPs on the porosity loss. The model results show that the assumptions for the iron corrosion rates on basis of a first-order dependency on iron surface area are only valid when no iron surface passivation is considered. The simulations demonstrate that volume-expansion by Fe(0) corrosion products alone can cause a great extent of porosity loss and suggests careful evaluation of the iron corrosion process in individual Fe(0)-based PRB.
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spelling pubmed-83791872021-08-27 Modeling porosity loss in Fe(0)-based permeable reactive barriers with Faraday’s law Yang, Huichen Hu, Rui Ruppert, Hans Noubactep, Chicgoua Sci Rep Article Solid iron corrosion products (FeCPs), continuously generated from iron corrosion in Fe(0)-based permeable reactive barriers (PRB) at pH > 4.5, can lead to significant porosity loss and possibility of system’s failure. To avoid such failure and to estimate the long-term performance of PRBs, reliable models are required. In this study, a mathematical model is presented to describe the porosity change of a hypothetical Fe(0)-based PRB through-flowed by deionized water. The porosity loss is solely caused by iron corrosion process. The new model is based on Faraday’s Law and considers the iron surface passivation. Experimental results from literature were used to calibrate the parameters of the model. The derived iron corrosion rates (2.60 mmol/(kg day), 2.07 mmol/(kg day) and 1.77 mmol/(kg day)) are significantly larger than the corrosion rate used in previous modeling studies (0.4 mmol/(kg day)). This suggests that the previous models have underestimated the impact of in-situ generated FeCPs on the porosity loss. The model results show that the assumptions for the iron corrosion rates on basis of a first-order dependency on iron surface area are only valid when no iron surface passivation is considered. The simulations demonstrate that volume-expansion by Fe(0) corrosion products alone can cause a great extent of porosity loss and suggests careful evaluation of the iron corrosion process in individual Fe(0)-based PRB. Nature Publishing Group UK 2021-08-20 /pmc/articles/PMC8379187/ /pubmed/34417542 http://dx.doi.org/10.1038/s41598-021-96599-8 Text en © The Author(s) 2021 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
Yang, Huichen
Hu, Rui
Ruppert, Hans
Noubactep, Chicgoua
Modeling porosity loss in Fe(0)-based permeable reactive barriers with Faraday’s law
title Modeling porosity loss in Fe(0)-based permeable reactive barriers with Faraday’s law
title_full Modeling porosity loss in Fe(0)-based permeable reactive barriers with Faraday’s law
title_fullStr Modeling porosity loss in Fe(0)-based permeable reactive barriers with Faraday’s law
title_full_unstemmed Modeling porosity loss in Fe(0)-based permeable reactive barriers with Faraday’s law
title_short Modeling porosity loss in Fe(0)-based permeable reactive barriers with Faraday’s law
title_sort modeling porosity loss in fe(0)-based permeable reactive barriers with faraday’s law
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8379187/
https://www.ncbi.nlm.nih.gov/pubmed/34417542
http://dx.doi.org/10.1038/s41598-021-96599-8
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