2020
Exploring the Mechanisms of Selectivity for Environmentally Significant Oxo-Anion Removal during Water Treatment: A Review of Common Competing Oxo-Anions and Tools for Quantifying Selective Adsorption
Pincus L, Rudel H, Petrović P, Gupta S, Westerhoff P, Muhich C, Zimmerman J. Exploring the Mechanisms of Selectivity for Environmentally Significant Oxo-Anion Removal during Water Treatment: A Review of Common Competing Oxo-Anions and Tools for Quantifying Selective Adsorption. Environmental Science And Technology 2020, 54: 9769-9790. PMID: 32515947, PMCID: PMC10514893, DOI: 10.1021/acs.est.0c01666.Peer-Reviewed Original ResearchConceptsSelective adsorbentDensity functional theorySelective adsorptionSelectivity of materialsOxo anionsNovel adsorbentCompetitive adsorptionElectrostatic interactionsSurface complexationMechanism of selectivityAdsorptive competitionSteric hindranceAdsorbentFunctional theoryAdsorptionSorption sitesWater treatmentSelectivityPollutant removal potentialRemoval potentialComplexationMechanistic approachMaterialsBase hardnessHindrance
2010
Toward molecular design for hazard reduction—fundamental relationships between chemical properties and toxicity
Voutchkova A, Ferris L, Zimmerman J, Anastas P. Toward molecular design for hazard reduction—fundamental relationships between chemical properties and toxicity. Tetrahedron 2010, 66: 1031-1039. DOI: 10.1016/j.tet.2009.11.002.Peer-Reviewed Original ResearchPhysical/chemical propertiesCommercial chemicalsChemical propertiesMolecular designChemical compoundsToxics Release InventoryCompoundsQikPropChemicalsChemical characteristicsPhysical propertiesPropertiesExcretion characteristicsEPA Toxics Release InventoryAdsorptionToxicity endpointsHuman toxicityTRI chemicalsRelease InventoryBioavailabilityToxicity