Interfacial adsorption mechanism of hydroxycinnamic acids on iron surfaces: A computational perspective toward eco-friendly corrosion mitigation strategies
Hassane Lgaz, Han‐Seung Lee
Topics & Concepts
Reactivity (psychology)ChemistryComputational chemistryDensity functional theoryAdsorptionMolecular dynamicsQuantum chemistryCorrosionMolecular orbitalFerulic acidNatural bond orbitalChemical physicsMoleculeOrganic chemistrySupramolecular chemistryMedicineAlternative medicineFood sciencePathologyCorrosion Behavior and InhibitionElectrochemical Analysis and ApplicationsConcrete Corrosion and Durability