Corrosion inhibition performance of azelaic acid dihydrazide: a molecular dynamics and Monte Carlo simulation study
Matine Abdelmalek, Ali Barhoumi, Said Byadi, Mohammed El Idrissi, Mohammed Salah, Abdessamad Tounsi, El Mokhtar El Ouardi, Habib El Alaoui El Abdallaoui, Abdellah Zeroual
Topics & Concepts
Molecular dynamicsDensity functional theoryAzelaic acidMonte Carlo methodComputational chemistryChemistryCorrosion inhibitorMoleculeAdsorptionPhysical chemistryMaterials scienceCorrosionChemical physicsOrganic chemistryStatisticsMathematicsCorrosion Behavior and InhibitionMaterial Properties and Failure MechanismsConcrete Corrosion and Durability