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Charge balance calculations for mixed salt systems applied to a large dataset from the built environment

Godts, Sebastiaan; Steiger, Michael; Orr, Scott Allan; De Kock, Tim; Desarnaud, Julie; De Clercq, Hilde; Cnudde, Veerle; (2022) Charge balance calculations for mixed salt systems applied to a large dataset from the built environment. Scientific Data , 9 (1) , Article 324. 10.1038/s41597-022-01445-9. (In press). Green open access

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Abstract

Understanding salt mixtures in the built environment is crucial to evaluate damage phenomena. This contribution presents charge balance calculations applied to a dataset of 11412 samples taken from 338 sites, building materials showing signs of salt deterioration. Each sample includes ion concentrations of Na^{+}, K^{+}, Mg^{2+}, Ca^{2+}, Cl^{−}, NO_{3}^{−}, and SO_{4}^{2−} adjusted to reach charge balance for data evaluation. The calculation procedure follows two distinct pathways: i) an equal adjustment of all ions, ii) adjustments to the cations in sequence related to the solubility of the theoretical solids. The procedure applied to the dataset illustrates the quantification of salt mixture compositions and highlights the extent of adjustments applied in relation to the sample mass to aid interpretation. The data analysis allows the identification of theoretical carbonates that could influence the mixture behavior. Applying the charge balance calculations to the dataset validated common ions found in the built environment and the identification of three typical mixture compositions. Additionally, the data can be used as direct input for thermodynamic modeling.

Type: Article
Title: Charge balance calculations for mixed salt systems applied to a large dataset from the built environment
Open access status: An open access version is available from UCL Discovery
DOI: 10.1038/s41597-022-01445-9
Publisher version: https://doi.org/10.1038/s41597-022-01445-9
Language: English
Additional information: © 2022 Springer Nature Limited. This article is licensed under a Creative Commons Attribution 4.0 International License (http://creativecommons.org/licenses/by/4.0/).
Keywords: Inorganic chemistry, Natural hazards, Phase transitions and critical phenomena, Thermodynamics
UCL classification: UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of the Built Environment
UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of the Built Environment > Bartlett School Env, Energy and Resources
UCL > Provost and Vice Provost Offices > UCL BEAMS
UCL
URI: https://discovery.ucl.ac.uk/id/eprint/10150463
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