Cl-induced passivity breakdown in α-Fe2O3 (0001), α-Cr2O3 (0001), and their interface: A DFT study
Xiaoran Yin, Haitao Wang, En‐Hou Han
Topics & Concepts
Vacancy defectChromiaMaterials scienceOxidePassivityDensity functional theoryChlorideDiffusionIonChemical physicsChemistryComputational chemistryMetallurgyCrystallographyThermodynamicsPhysicsOrganic chemistryElectrical engineeringEngineeringHydrogen embrittlement and corrosion behaviors in metalsCorrosion Behavior and InhibitionHigh-Temperature Coating Behaviors