Multi-scale modeling of natural organic matter–heavy metal cations interactions: Aggregation and stabilization mechanisms
Zhiyu Zhou, Chi Zhang, Mengning Xi, Haonan Ma, Hanzhong Jia
Topics & Concepts
ChemistryMetalIntermolecular forceOuter sphere electron transferAqueous solutionMolecular dynamicsAdsorptionMetal ions in aqueous solutionChelationMoleculeDissolved organic carbonChemical physicsInorganic chemistryComputational chemistryEnvironmental chemistryPhysical chemistryOrganic chemistryIonHeavy metals in environmentRadioactive element chemistry and processingSpectroscopy and Quantum Chemical Studies