Review of Recent Computational Research on the Adsorption of PFASs with a Variety of Substrates

Review of Recent Computational Research on the Adsorption of PFASs with a Variety of Substrates

The widespread use and impervious nature of per- and polyfluorinated alkyl substances (PFASs) is leading to potentially harmful exposure in numerous environments. One avenue to explore remediation of PFAS-contaminated environments involves investigating how well PFASs adsorb onto various substrates....

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Bibliographic Details
Main Authors: Alfonso Minervino, Kevin D. Belfield
Format: Article
Language:English
Published: MDPI AG 2024-03-01
Series:International Journal of Molecular Sciences
Subjects:
PFASs
adsorption mechanisms
computational chemistry
density functional theory (DFT)
molecular dynamics (MD)
Online Access:https://www.mdpi.com/1422-0067/25/6/3445

Internet

https://www.mdpi.com/1422-0067/25/6/3445

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