Detailed DFT/MD simulation, QSAR modeling, electrochemical, and surface morphological studies of self-assembled surfactants as eco-friendly corrosion inhibitors for copper in 1 M HNO3 solution
Ahmed A. Farag, Salah M. Tawfik, Ali A. Abd‐Elaal, N.S. Abdelshafi
Topics & Concepts
Dielectric spectroscopyElectrochemistryChemistryDensity functional theoryElectrolyteCorrosionPulmonary surfactantQuantitative structure–activity relationshipAdsorptionMolecular orbitalSubstrate (aquarium)Langmuir adsorption modelMoleculePhysical chemistryComputational chemistryStereochemistryOrganic chemistryElectrodeGeologyOceanographyBiochemistryCorrosion Behavior and InhibitionConcrete Corrosion and DurabilityHydrogen embrittlement and corrosion behaviors in metals