Review of Recent Computational Research on the Adsorption of PFASs with a Variety of Substrates
Alfonso Minervino,
Kevin D. Belfield
Abstract: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. In the current review, we focus on summarizing recent computational research, largely involving density functional theory (DFT) and molecular dynamics (MD), into the adsorption and interaction of PFASs with a varie… Show more
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