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DFT study on the effect of functional groups of carbonaceous surface on ammonium adsorption from water

Qianqian Yin, Linhui Si, Ruikun Wang, Zhenghui Zhao, Heping Li, Zhengcheng Wen

2021Chemosphere57 citationsDOI

Topics & Concepts

AdsorptionElectronegativityDensity functional theoryChemistryFunctional groupInorganic chemistryAmmoniumMoleculeChemical polarityCarbon fibersIonDipoleComputational chemistryOrganic chemistryMaterials scienceComposite numberPolymerComposite materialAdsorption and biosorption for pollutant removalAmmonia Synthesis and Nitrogen ReductionGraphene research and applications
DFT study on the effect of functional groups of carbonaceous surface on ammonium adsorption from water | Litcius