Integrating experimental and ab initio DFT approaches to evaluate chalcone derivatives as corrosion inhibitors for mild steel in acidic environment
Vinícius M. dos Santos, Caio Machado Fernandes, Marcelo T. G. de Sampaio, Kaio R. Lucio, Javier Velasco, Fanny L. Salazar, Leonardo X. Álvarez, Hassane Lgaz, Eduardo A. Ponzio
Topics & Concepts
ChalconeAb initioComputational chemistryCorrosionChemistryAb initio quantum chemistry methodsMaterials scienceOrganic chemistryMoleculeCorrosion Behavior and InhibitionConcrete Corrosion and DurabilityHydrogen embrittlement and corrosion behaviors in metals