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Geochemical contamination signatures: Insights from information theory and cokriging— a compositional approach

datacite.subject.fosCiências Naturais
datacite.subject.sdg13:Ação Climática
datacite.subject.sdg15:Proteger a Vida Terrestre
dc.contributor.authorPazo, María
dc.contributor.authorAlbuquerque, M.T.D.
dc.contributor.authorRoque, Natália
dc.contributor.authorRita Fonseca
dc.date.accessioned2026-04-15T16:02:37Z
dc.date.available2026-04-15T16:02:37Z
dc.date.issued2026
dc.description.abstractPotentially toxic elements (PTEs) such as arsenic (As) and mercury (Hg) are among the most critical pollutants globally, threatening ecosystem integrity and human health. The Trimpancho mining system in the Iberian Pyrite Belt (W Spain) is one such hotspot, where centuries of activity have left a legacy of acid mine drainage and heavy metal dispersion. This study employs an integrated compositional, probabilistic, and spatial modeling framework to characterize and map contamination dynamics in this area with quantified uncertainty. A total of 31 water samples were collected during 2022 and 2023 from surface streams and tributaries. Concentration data were transformed using isometric log-ratio (ilr) techniques to preserve their compositional nature and avoid spurious correlations. Bayesian Networks (BNs), combined with information-theoretic metrics, were then applied to identify latent geochemical contamination patterns and quantify both aleatory and epistemic uncertainties. The key drivers identified were incorporated into a co-kriging framework, enabling spatial interpolation that accounted for over 90% of total variance and reduced epistemic uncertainty by 22.7% compared to raw-data models. The resulting spatial–temporal maps revealed distinct As– Hg contamination signatures, influenced by hydrological variability and mining legacy sources. In conclusion, this integrated approach provides a robust, uncertainty-aware methodology for detecting, interpreting, and mapping contamination patterns, offering actionable insights for environmental risk assessment and remediation planning in mining-impacted watersheds.eng
dc.identifier.citationPAZO, M. [et al.] (2026) - Geochemical contamination signatures: Insights from information theory and cokriging—a compositional approach. Water Air Soil Pollut. 237, 709. DOI: 10.1007/s11270-026-09389-1
dc.identifier.doi10.1007/s11270-026-09389-1
dc.identifier.urihttp://hdl.handle.net/10400.11/10841
dc.language.isoeng
dc.peerreviewedyes
dc.publisherSpringer
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/
dc.subjectPyritic Belt · Bayesian network · CoDA · Spatial modeling · Stream sediment
dc.subjectBayesian network
dc.subjectCoDA
dc.subjectSpatial modeling
dc.subjectUncertainty
dc.titleGeochemical contamination signatures: Insights from information theory and cokriging— a compositional approacheng
dc.typejournal article
dspace.entity.typePublication
oaire.citation.endPage709
oaire.citation.startPage237
oaire.citation.titleWater Air Soil Pollution
oaire.versionhttp://purl.org/coar/version/c_970fb48d4fbd8a85
person.familyNameAlbuquerque
person.familyNameMartins Roque
person.givenNameMaria Teresa
person.givenNameNatália
person.identifierNatália Martins Roque
person.identifier.ciencia-id5A1C-8956-4C0A
person.identifier.ciencia-id451A-332D-0798
person.identifier.orcid0000-0002-8782-6133
person.identifier.orcid0000-0001-8859-4365
person.identifier.ridB-1536-2013
person.identifier.scopus-author-id55507421600
person.identifier.scopus-author-id57200227653
relation.isAuthorOfPublicatione2c2d171-e148-4c23-9cf8-0eb6d810c15e
relation.isAuthorOfPublicationfaca1743-7a98-4404-acef-ab73a684d3c2
relation.isAuthorOfPublication.latestForDiscoverye2c2d171-e148-4c23-9cf8-0eb6d810c15e

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